Library Search Compound Report Data Path : W:\HPCHEM1\MSVOA_U\DATA\VU050718\ Data File : VU023720.D Acq On : 07 May 2018 18:10 Operator : MD/SY Sample : J2725-08 Misc : 5.0mL/MSVOA_U/WATER ALS Vial : 18 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 Sulfur dioxide Concentration Rank 18 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 1.30 3.97 ug/L 66675 1,4-Difluorobenzene 5.89 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Sulfur dioxide 64 O2S 007446-09-5 74 2 L-Alanine, 3-sulfo- 169 C3H7NO5S 000498-40-8 64 3 Aminomethanesulfonic acid 111 CH5NO3S 013881-91-9 64 4 Sulfur dioxide 64 O2S 007446-09-5 4 5 Ethene, 1,1-difluoro- 64 C2H2F2 000075-38-7 4 ********************************************************************* Peak Number 2 Benzene, 1-ethenyl-4-ethyl- Concentration Rank 8 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 12.36 13.02 ug/L 276612 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzene, 1-ethenyl-4-ethyl- 132 C10H12 003454-07-7 87 2 Benzene, 1-ethenyl-3-ethyl- 132 C10H12 007525-62-4 87 3 Indan, 1-methyl- 132 C10H12 000767-58-8 87 4 1-Phenyl-1-butene 132 C10H12 000824-90-8 86 5 Benzene, (2-methylcyclopropyl)- 132 C10H12 1000327-39-0 81 ********************************************************************* Peak Number 3 Benzofuran, 2,3-dihydro- Concentration Rank 9 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 12.48 9.17 ug/L 194784 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzofuran, 2,3-dihydro- 120 C8H8O 000496-16-2 87 2 Benzofuran, 2,3-dihydro- 120 C8H8O 000496-16-2 83 3 Benzeneacetaldehyde 120 C8H8O 000122-78-1 58 4 Benzaldehyde, 2-methyl- 120 C8H8O 000529-20-4 58 5 Phthalan 120 C8H8O 000496-14-0 58 ********************************************************************* Peak Number 4 Benzofuran, 2-methyl- Concentration Rank 3 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 12.60 41.85 ug/L 889395 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzofuran, 2-methyl- 132 C9H8O 004265-25-2 94 2 Benzofuran, 7-methyl- 132 C9H8O 017059-52-8 94 3 1H-Indenol 132 C9H8O 056631-57-3 91 4 3-Phenyl-2-propyn-1-ol 132 C9H8O 001504-58-1 91 5 Benzofuran, 2-methyl- 132 C9H8O 004265-25-2 91 ********************************************************************* Peak Number 5 Benzene, (1-methyl-2-cyclop... Concentration Rank 14 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 13.19 5.64 ug/L 119935 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzene, (1-methyl-2-cyclopropen... 130 C10H10 065051-83-4 97 2 2-Methylindene 130 C10H10 002177-47-1 97 3 Cycloprop[a]indene, 1,1a,6,6a-te... 130 C10H10 015677-15-3 97 4 1H-Indene, 1-methyl- 130 C10H10 000767-59-9 96 5 1,4-Dihydronaphthalene 130 C10H10 000612-17-9 96 ********************************************************************* Peak Number 6 2-Methylindene Concentration Rank 17 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 13.30 5.18 ug/L 110047 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 2-Methylindene 130 C10H10 002177-47-1 96 2 Benzene, (1-methyl-2-cyclopropen... 130 C10H10 065051-83-4 96 3 1H-Indene, 1-methyl- 130 C10H10 000767-59-9 96 4 1H-Indene, 1-methyl- 130 C10H10 000767-59-9 94 5 1H-Indene, 3-methyl- 130 C10H10 000767-60-2 94 ********************************************************************* Peak Number 7 Benzo[b]thiophene Concentration Rank 20 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 13.86 3.24 ug/L 68924 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzo[b]thiophene 134 C8H6S 000095-15-8 90 2 Benzo[c]thiophene 134 C8H6S 000270-82-6 60 3 Benzo[b]thiophene 134 C8H6S 000095-15-8 55 4 Benzo[b]thiophene 134 C8H6S 000095-15-8 53 5 2-Benzoxazolamine 134 C7H6N2O 004570-41-6 38 ********************************************************************* Peak Number 8 Benzo[b]thiophene, 2,3-dihy... Concentration Rank 4 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 14.54 29.03 ug/L 616866 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 94 2 Benzo[c]thiophene, 1,3-dihydro- 136 C8H8S 002471-92-3 81 3 Benzo[b]thiophene, 2,3-dihydro- 136 C8H8S 004565-32-6 70 4 Benzaldehyde, 4-methoxy- 136 C8H8O2 000123-11-5 64 5 Benzaldehyde, 4-methoxy- 136 C8H8O2 000123-11-5 64 ********************************************************************* Peak Number 9 Benzo[b]thiophene, 2-methyl- Concentration Rank 12 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 14.82 6.61 ug/L 140573 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzo[b]thiophene, 2-methyl- 148 C9H8S 001195-14-8 90 2 Benzo[b]thiophene, 2-methyl- 148 C9H8S 001195-14-8 90 3 3-Methylbenzothiophene 148 C9H8S 001455-18-1 90 4 Benzo[b]thiophene, 5-methyl- 148 C9H8S 014315-14-1 87 5 Benzo[b]thiophene, 4-methyl- 148 C9H8S 014315-11-8 87 ********************************************************************* Peak Number 10 Naphthalene, 1-methyl- Concentration Rank 15 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 15.07 5.42 ug/L 115255 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Naphthalene, 1-methyl- 142 C11H10 000090-12-0 91 2 Naphthalene, 2-methyl- 142 C11H10 000091-57-6 90 3 Benzocycloheptatriene 142 C11H10 000264-09-5 89 4 Naphthalene, 1-methyl- 142 C11H10 000090-12-0 70 5 Benzo[b]thiophene, 4-methyl- 148 C9H8S 014315-11-8 55 ********************************************************************* Peak Number 11 Naphthalene, 1,3-dimethyl- Concentration Rank 13 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 16.43 5.80 ug/L 123322 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 97 2 Naphthalene, 1,3-dimethyl- 156 C12H12 000575-41-7 97 3 Naphthalene, 1,4-dimethyl- 156 C12H12 000571-58-4 96 4 Naphthalene, 2,3-dimethyl- 156 C12H12 000581-40-8 96 5 Naphthalene, 2,3-dimethyl- 156 C12H12 000581-40-8 96 ********************************************************************* Peak Number 12 1-Isopropenylnaphthalene Concentration Rank 11 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 16.92 6.92 ug/L 147058 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 1-Isopropenylnaphthalene 168 C13H12 001855-47-6 86 2 Ethanone, 1-(2,3,4-trihydroxyphe... 168 C8H8O4 000528-21-2 53 3 Ethanone, 1-(2,4,6-trihydroxyphe... 168 C8H8O4 000480-66-0 52 4 Ethanone, 1-(2,4,6-trihydroxyphe... 168 C8H8O4 000480-66-0 50 5 Naphthalene, 1-(2-propenyl)- 168 C13H12 002489-86-3 50 ********************************************************************* Peak Number 13 Dibenzofuran Concentration Rank 19 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 17.04 3.26 ug/L 69343 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Dibenzofuran 168 C12H8O 000132-64-9 94 2 Dibenzofuran 168 C12H8O 000132-64-9 64 3 Naphtho[2,1-d]imidazole 168 C11H8N2 000233-53-4 59 4 3,5-Dimethoxybenzyl alcohol 168 C9H12O3 000705-76-0 50 5 1(2H)-Acenaphthylenone 168 C12H8O 002235-15-6 47