Library Search Compound Report Data Path : W:\HPCHEM1\MSVOA_U\DATA\VU050718\ Data File : VU023716.D Acq On : 07 May 2018 15:28 Operator : MD/SY Sample : J2725-04 Misc : 5.0mL/MSVOA_U/WATER ALS Vial : 13 Sample Multiplier: 1 Quant Method : W:\HPCHEM1\MSVOA_U\METHOD\SOMULM050118WMA.M Quant Title : VOC Analysis TIC Library : C:\DATABASE\NIST11.L TIC Integration Parameters: LSCINT.P ********************************************************************* Peak Number 1 Benzofuran Concentration Rank 30 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 11.40 2.98 ug/L 63776 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzofuran 118 C8H6O 000271-89-6 94 2 Benzofuran 118 C8H6O 000271-89-6 90 3 Benzofuran 118 C8H6O 000271-89-6 72 4 2H-Cyclopenta[d]pyridazine 118 C7H6N2 000270-64-4 64 5 1H-Pyrrolo[2,3-b]pyridine 118 C7H6N2 000271-63-6 59 ********************************************************************* Peak Number 2 Indane Concentration Rank 12 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 11.77 16.92 ug/L 362002 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Indane 118 C9H10 000496-11-7 95 2 Indane 118 C9H10 000496-11-7 91 3 Indane 118 C9H10 000496-11-7 90 4 Benzene, 1-ethenyl-4-methyl- 118 C9H10 000622-97-9 83 5 7-Methylenecycloocta-1,3,5-triene 118 C9H10 002570-13-0 72 ********************************************************************* Peak Number 3 Indene Concentration Rank 7 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 11.99 20.51 ug/L 438713 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Indene 116 C9H8 000095-13-6 97 2 Benzene, 1-propynyl- 116 C9H8 000673-32-5 94 3 Indene 116 C9H8 000095-13-6 94 4 Indene 116 C9H8 000095-13-6 93 5 3-Methylphenylacetylene 116 C9H8 000766-82-5 91 ********************************************************************* Peak Number 4 Indan, 1-methyl- Concentration Rank 22 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 12.36 5.73 ug/L 122567 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Indan, 1-methyl- 132 C10H12 000767-58-8 87 2 Benzene, 2-butenyl- 132 C10H12 001560-06-1 87 3 Benzene, 1-ethenyl-4-ethyl- 132 C10H12 003454-07-7 87 4 Benzene, 1-methyl-2-(2-propenyl)- 132 C10H12 001587-04-8 86 5 Indan, 1-methyl- 132 C10H12 000767-58-8 81 ********************************************************************* Peak Number 5 3-Phenyl-2-propyn-1-ol Concentration Rank 16 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 12.60 10.37 ug/L 221817 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 3-Phenyl-2-propyn-1-ol 132 C9H8O 001504-58-1 94 2 Benzofuran, 2-methyl- 132 C9H8O 004265-25-2 94 3 Benzofuran, 7-methyl- 132 C9H8O 017059-52-8 94 4 Cinnamaldehyde, (E)- 132 C9H8O 014371-10-9 91 5 Benzofuran, 2-methyl- 132 C9H8O 004265-25-2 91 ********************************************************************* Peak Number 6 Benzofuran, 7-methyl- Concentration Rank 9 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 12.70 18.12 ug/L 387753 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzofuran, 7-methyl- 132 C9H8O 017059-52-8 96 2 Benzofuran, 2-methyl- 132 C9H8O 004265-25-2 93 3 3-Phenyl-2-propyn-1-ol 132 C9H8O 001504-58-1 90 4 Benzofuran, 2-methyl- 132 C9H8O 004265-25-2 90 5 Benzofuran, 2-methyl- 132 C9H8O 004265-25-2 87 ********************************************************************* Peak Number 7 1H-Indene, 2,3-dihydro-4-me... Concentration Rank 24 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 12.97 4.99 ug/L 106701 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 1H-Indene, 2,3-dihydro-4-methyl- 132 C10H12 000824-22-6 90 2 1H-Indene, 2,3-dihydro-5-methyl- 132 C10H12 000874-35-1 90 3 3-Phenylbut-1-ene 132 C10H12 000934-10-1 87 4 Benzene, 1-ethenyl-4-ethyl- 132 C10H12 003454-07-7 81 5 Indan, 1-methyl- 132 C10H12 000767-58-8 81 ********************************************************************* Peak Number 8 Benzene, 2-ethenyl-1,4-dime... Concentration Rank 13 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 13.13 16.62 ug/L 355678 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzene, 2-ethenyl-1,4-dimethyl- 132 C10H12 002039-89-6 95 2 Benzene, 1-ethenyl-4-ethyl- 132 C10H12 003454-07-7 93 3 1H-Indene, 2,3-dihydro-4-methyl- 132 C10H12 000824-22-6 87 4 3-Phenylbut-1-ene 132 C10H12 000934-10-1 81 5 Benzene, 1-ethenyl-3-ethyl- 132 C10H12 007525-62-4 76 ********************************************************************* Peak Number 9 Cycloprop[a]indene, 1,1a,6,... Concentration Rank 28 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 13.19 3.21 ug/L 68663 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Cycloprop[a]indene, 1,1a,6,6a-te... 130 C10H10 015677-15-3 96 2 2-Methylindene 130 C10H10 002177-47-1 96 3 1H-Indene, 1-methyl- 130 C10H10 000767-59-9 95 4 1,4-Dihydronaphthalene 130 C10H10 000612-17-9 95 5 Benzene, (1-methyl-2-cyclopropen... 130 C10H10 065051-83-4 94 ********************************************************************* Peak Number 10 2-Methylindene Concentration Rank 27 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 13.30 3.85 ug/L 82361 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 2-Methylindene 130 C10H10 002177-47-1 97 2 Benzene, (1-methyl-2-cyclopropen... 130 C10H10 065051-83-4 97 3 1H-Indene, 1-methyl- 130 C10H10 000767-59-9 96 4 1,4-Dihydronaphthalene 130 C10H10 000612-17-9 96 5 1,4-Dihydronaphthalene 130 C10H10 000612-17-9 96 ********************************************************************* Peak Number 11 Phenol, 2,3-dimethyl- Concentration Rank 26 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 13.62 4.25 ug/L 90876 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Phenol, 2,3-dimethyl- 122 C8H10O 000526-75-0 97 2 Phenol, 2,5-dimethyl- 122 C8H10O 000095-87-4 96 3 Phenol, 2,4-dimethyl- 122 C8H10O 000105-67-9 96 4 Phenol, 2,3-dimethyl- 122 C8H10O 000526-75-0 96 5 Phenol, 2,3-dimethyl- 122 C8H10O 000526-75-0 96 ********************************************************************* Peak Number 12 Benzo[c]thiophene Concentration Rank 10 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 13.86 18.00 ug/L 385051 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzo[c]thiophene 134 C8H6S 000270-82-6 97 2 Benzo[b]thiophene 134 C8H6S 000095-15-8 97 3 Benzo[b]thiophene 134 C8H6S 000095-15-8 95 4 Cyclopenta[c]thiapyran 134 C8H6S 000270-63-3 94 5 Benzo[b]thiophene 134 C8H6S 000095-15-8 91 ********************************************************************* Peak Number 13 1H-Indene-4-carboxaldehyde,... Concentration Rank 31 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 13.96 2.67 ug/L 57227 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 1H-Indene-4-carboxaldehyde, 2,3-... 146 C10H10O 051932-70-8 70 2 1H-Indene-4-carboxaldehyde, 2,3-... 146 C10H10O 051932-70-8 70 3 2-Ethyl-2,3-dihydro-1H-indene 146 C11H14 056147-63-8 64 4 1-Naphthalenol, 5,8-dihydro- 146 C10H10O 027673-48-9 58 5 1H-Benzimidazole, 5,6-dimethyl- 146 C9H10N2 000582-60-5 53 ********************************************************************* Peak Number 14 Benzo[b]thiophene, 2,3-dihy... Concentration Rank 25 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 14.54 4.71 ug/L 100790 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzo[b]thiophene, 2,3-dihydro- 136 C8H8S 004565-32-6 87 2 Benzo[c]thiophene, 1,3-dihydro- 136 C8H8S 002471-92-3 81 3 Benzaldehyde, 2-hydroxy-4-methyl- 136 C8H8O2 000698-27-1 64 4 Benzo[b]thiophene, 2,3-dihydro- 136 C8H8S 004565-32-6 64 5 2-Hydroxy-5-methylbenzaldehyde 136 C8H8O2 000613-84-3 64 ********************************************************************* Peak Number 15 Benzo[b]thiophene, 6-methyl- Concentration Rank 21 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 14.82 5.81 ug/L 124229 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzo[b]thiophene, 6-methyl- 148 C9H8S 016587-47-6 94 2 Benzo[b]thiophene, 2-methyl- 148 C9H8S 001195-14-8 91 3 Benzo[b]thiophene, 2-methyl- 148 C9H8S 001195-14-8 91 4 3-Methylbenzothiophene 148 C9H8S 001455-18-1 90 5 Benzo[b]thiophene, 5-methyl- 148 C9H8S 014315-14-1 90 ********************************************************************* Peak Number 16 Naphthalene, 1-methyl- Concentration Rank 5 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 14.88 53.86 ug/L 1152320 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Naphthalene, 1-methyl- 142 C11H10 000090-12-0 96 2 Naphthalene, 2-methyl- 142 C11H10 000091-57-6 96 3 Naphthalene, 2-methyl- 142 C11H10 000091-57-6 96 4 Naphthalene, 2-methyl- 142 C11H10 000091-57-6 94 5 Naphthalene, 1-methyl- 142 C11H10 000090-12-0 94 ********************************************************************* Peak Number 17 Biphenyl Concentration Rank 6 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 15.61 24.79 ug/L 530319 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Biphenyl 154 C12H10 000092-52-4 95 2 Biphenyl 154 C12H10 000092-52-4 95 3 Biphenyl 154 C12H10 000092-52-4 94 4 Biphenyl 154 C12H10 000092-52-4 93 5 Naphthalene, 2-ethenyl- 154 C12H10 000827-54-3 87 ********************************************************************* Peak Number 18 Naphthalene, 2,6-dimethyl- Concentration Rank 17 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 15.92 9.40 ug/L 201137 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Naphthalene, 2,6-dimethyl- 156 C12H12 000581-42-0 98 2 Naphthalene, 1,5-dimethyl- 156 C12H12 000571-61-9 98 3 Naphthalene, 2,6-dimethyl- 156 C12H12 000581-42-0 98 4 Naphthalene, 2,6-dimethyl- 156 C12H12 000581-42-0 97 5 Naphthalene, 1,7-dimethyl- 156 C12H12 000575-37-1 97 ********************************************************************* Peak Number 19 Naphthalene, 1,7-dimethyl- Concentration Rank 8 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 16.07 19.54 ug/L 418118 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Naphthalene, 1,7-dimethyl- 156 C12H12 000575-37-1 98 2 Naphthalene, 2,3-dimethyl- 156 C12H12 000581-40-8 97 3 Naphthalene, 2,3-dimethyl- 156 C12H12 000581-40-8 97 4 Naphthalene, 1,8-dimethyl- 156 C12H12 000569-41-5 97 5 Naphthalene, 1,6-dimethyl- 156 C12H12 000575-43-9 97 ********************************************************************* Peak Number 20 Naphthalene, 1,5-dimethyl- Concentration Rank 11 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 16.10 17.85 ug/L 381955 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Naphthalene, 1,5-dimethyl- 156 C12H12 000571-61-9 98 2 Naphthalene, 1,6-dimethyl- 156 C12H12 000575-43-9 97 3 Naphthalene, 2,6-dimethyl- 156 C12H12 000581-42-0 97 4 Naphthalene, 1,5-dimethyl- 156 C12H12 000571-61-9 97 5 Naphthalene, 1,6-dimethyl- 156 C12H12 000575-43-9 97 ********************************************************************* Peak Number 21 Naphthalene, 1,3-dimethyl- Concentration Rank 29 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 16.26 3.17 ug/L 67796 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Naphthalene, 1,3-dimethyl- 156 C12H12 000575-41-7 98 2 Naphthalene, 2,3-dimethyl- 156 C12H12 000581-40-8 98 3 Naphthalene, 1,2-dimethyl- 156 C12H12 000573-98-8 98 4 Naphthalene, 1,4-dimethyl- 156 C12H12 000571-58-4 97 5 Naphthalene, 2,3-dimethyl- 156 C12H12 000581-40-8 97 ********************************************************************* Peak Number 22 Naphthalene, 2,3-dimethyl- Concentration Rank 20 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 16.44 6.80 ug/L 145481 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Naphthalene, 2,3-dimethyl- 156 C12H12 000581-40-8 97 2 Naphthalene, 1,3-dimethyl- 156 C12H12 000575-41-7 97 3 Naphthalene, 2,3-dimethyl- 156 C12H12 000581-40-8 97 4 Naphthalene, 2,3-dimethyl- 156 C12H12 000581-40-8 97 5 Naphthalene, 1,7-dimethyl- 156 C12H12 000575-37-1 97 ********************************************************************* Peak Number 23 1-Isopropenylnaphthalene Concentration Rank 19 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 16.92 7.07 ug/L 151245 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 1-Isopropenylnaphthalene 168 C13H12 001855-47-6 91 2 Naphthalene, 1-(2-propenyl)- 168 C13H12 002489-86-3 56 3 Ethanone, 1-(2,4,6-trihydroxyphe... 168 C8H8O4 000480-66-0 52 4 Ethanone, 1-(2,3,4-trihydroxyphe... 168 C8H8O4 000528-21-2 50 5 Ethanone, 1-(2,4,6-trihydroxyphe... 168 C8H8O4 000480-66-0 50 ********************************************************************* Peak Number 24 Dibenzofuran Concentration Rank 15 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 17.04 14.89 ug/L 318580 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Dibenzofuran 168 C12H8O 000132-64-9 91 2 Dibenzofuran 168 C12H8O 000132-64-9 87 3 3,5-Dimethoxybenzyl alcohol 168 C9H12O3 000705-76-0 56 4 Naphtho[2,1-d]imidazole 168 C11H8N2 000233-53-4 53 5 3,6-Diazahomoadamantan-9-ol 168 C9H16N2O 138023-21-9 50