Library Search Compound Report Data Path : W:\HPCHEM1\MSVOA_U\DATA\VU050818\ Data File : VU023745.D Acq On : 08 May 2018 19:10 Operator : MD/SY Sample : J2725-10DL 5X Misc : 5.0mL/MSVOA_U/WATER ALS Vial : 22 Sample Multiplier: 1 Quant Method : W:\HPCHEM1\MSVOA_U\METHOD\SOMULM050818WMA.M Quant Title : VOC Analysis TIC Library : C:\DATABASE\NIST11.L TIC Integration Parameters: LSCINT.P ********************************************************************* Peak Number 1 Sulfur dioxide Concentration Rank 27 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 1.30 5.58 ug/L 91040 1,4-Difluorobenzene 5.89 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Sulfur dioxide 64 O2S 007446-09-5 90 2 Aminomethanesulfonic acid 111 CH5NO3S 013881-91-9 74 3 Aminomethanesulfonic acid 111 CH5NO3S 013881-91-9 9 4 L-Alanine, 3-sulfo- 169 C3H7NO5S 000498-40-8 9 5 Ethene, 1,1-difluoro- 64 C2H2F2 000075-38-7 4 ********************************************************************* Peak Number 2 Benzene, 1-ethyl-2-methyl- Concentration Rank 21 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 10.69 8.86 ug/L 202003 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzene, 1-ethyl-2-methyl- 120 C9H12 000611-14-3 95 2 Benzene, 1-ethyl-2-methyl- 120 C9H12 000611-14-3 94 3 Benzene, 1-ethyl-3-methyl- 120 C9H12 000620-14-4 94 4 Benzene, 1,2,4-trimethyl- 120 C9H12 000095-63-6 91 5 Benzene, 1-ethyl-2-methyl- 120 C9H12 000611-14-3 91 ********************************************************************* Peak Number 3 Benzene, 1,2,3-trimethyl- Concentration Rank 24 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 10.78 8.17 ug/L 186137 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzene, 1,2,3-trimethyl- 120 C9H12 000526-73-8 97 2 Mesitylene 120 C9H12 000108-67-8 95 3 Benzene, 1,2,3-trimethyl- 120 C9H12 000526-73-8 95 4 Benzene, 1,2,4-trimethyl- 120 C9H12 000095-63-6 95 5 Mesitylene 120 C9H12 000108-67-8 94 ********************************************************************* Peak Number 4 Benzene, 1-ethenyl-3-methyl- Concentration Rank 29 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 11.22 4.69 ug/L 106813 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzene, 1-ethenyl-3-methyl- 118 C9H10 000100-80-1 96 2 Benzene, 1-ethenyl-3-methyl- 118 C9H10 000100-80-1 96 3 Benzene, 1-ethenyl-3-methyl- 118 C9H10 000100-80-1 95 4 Benzene, 1-ethenyl-4-methyl- 118 C9H10 000622-97-9 95 5 Benzene, 1-propenyl- 118 C9H10 000637-50-3 94 ********************************************************************* Peak Number 5 Benzofuran Concentration Rank 12 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 11.40 27.10 ug/L 617846 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzofuran 118 C8H6O 000271-89-6 90 2 Benzofuran 118 C8H6O 000271-89-6 90 3 2H-Cyclopenta[d]pyridazine 118 C7H6N2 000270-64-4 64 4 1H-Pyrrolo[2,3-b]pyridine 118 C7H6N2 000271-63-6 59 5 Benzofuran 118 C8H6O 000271-89-6 50 ********************************************************************* Peak Number 6 Indane Concentration Rank 3 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 11.77 254.34 ug/L 5798010 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Indane 118 C9H10 000496-11-7 93 2 Indane 118 C9H10 000496-11-7 91 3 Indane 118 C9H10 000496-11-7 87 4 Deltacyclene 118 C9H10 007785-10-6 72 5 Benzene, 1-ethenyl-4-methyl- 118 C9H10 000622-97-9 64 ********************************************************************* Peak Number 7 Indene Concentration Rank 2 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 11.99 527.01 ug/L 12013700 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Indene 116 C9H8 000095-13-6 97 2 Indene 116 C9H8 000095-13-6 95 3 Benzene, 1-propynyl- 116 C9H8 000673-32-5 94 4 Indene 116 C9H8 000095-13-6 94 5 Benzene, 1-ethynyl-4-methyl- 116 C9H8 000766-97-2 91 ********************************************************************* Peak Number 8 Benzene, 4-ethyl-1,2-dimethyl- Concentration Rank 31 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 12.26 3.61 ug/L 82207 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzene, 4-ethyl-1,2-dimethyl- 134 C10H14 000934-80-5 95 2 Benzene, 1-ethyl-2,3-dimethyl- 134 C10H14 000933-98-2 95 3 Benzene, 2-ethyl-1,4-dimethyl- 134 C10H14 001758-88-9 94 4 Benzene, 1-ethyl-2,4-dimethyl- 134 C10H14 000874-41-9 94 5 p-Cymene 134 C10H14 000099-87-6 94 ********************************************************************* Peak Number 9 Indan, 1-methyl- Concentration Rank 26 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 12.36 5.93 ug/L 135291 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Indan, 1-methyl- 132 C10H12 000767-58-8 90 2 Benzene, 1-ethenyl-3-ethyl- 132 C10H12 007525-62-4 90 3 Benzene, (2-methylcyclopropyl)- 132 C10H12 1000327-39-0 87 4 1H-Indene, 2,3-dihydro-4-methyl- 132 C10H12 000824-22-6 83 5 Indan, 1-methyl- 132 C10H12 000767-58-8 81 ********************************************************************* Peak Number 10 Benzofuran, 2-methyl- Concentration Rank 9 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 12.60 46.11 ug/L 1051120 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 Cinnamaldehyde, (E)- 132 C9H8O 014371-10-9 91 4 Benzofuran, 2-methyl- 132 C9H8O 004265-25-2 91 5 Benzofuran, 2-methyl- 132 C9H8O 004265-25-2 91 ********************************************************************* Peak Number 11 Benzofuran, 7-methyl- Concentration Rank 6 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 12.70 93.26 ug/L 2126040 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzofuran, 7-methyl- 132 C9H8O 017059-52-8 94 2 Benzofuran, 2-methyl- 132 C9H8O 004265-25-2 94 3 3-Phenyl-2-propyn-1-ol 132 C9H8O 001504-58-1 91 4 2-Propenal, 3-phenyl- 132 C9H8O 000104-55-2 91 5 Benzofuran, 2-methyl- 132 C9H8O 004265-25-2 91 ********************************************************************* Peak Number 12 Benzene, 2-ethenyl-1,4-dime... Concentration Rank 22 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 12.97 8.51 ug/L 193979 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 96 2 Benzene, 1-ethenyl-4-ethyl- 132 C10H12 003454-07-7 94 3 1H-Indene, 2,3-dihydro-4-methyl- 132 C10H12 000824-22-6 91 4 1-Phenyl-1-butene 132 C10H12 000824-90-8 87 5 3-Phenylbut-1-ene 132 C10H12 000934-10-1 87 ********************************************************************* Peak Number 13 Benzene, (1-methyl-2-cyclop... Concentration Rank 14 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 13.19 25.20 ug/L 574394 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 1H-Indene, 1-methyl- 130 C10H10 000767-59-9 96 4 Cycloprop[a]indene, 1,1a,6,6a-te... 130 C10H10 015677-15-3 95 5 1H-Indene, 1-methyl- 130 C10H10 000767-59-9 95 ********************************************************************* Peak Number 14 Benzo[c]thiophene Concentration Rank 5 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 13.86 154.32 ug/L 3517880 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 95 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 15 Benzo[b]thiophene, 2,3-dihy... Concentration Rank 32 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 14.54 3.11 ug/L 70993 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 76 2 Benzo[c]thiophene, 1,3-dihydro- 136 C8H8S 002471-92-3 76 3 Benzene, (ethenylthio)- 136 C8H8S 001822-73-7 62 4 Benzo[b]thiophene, 2,3-dihydro- 136 C8H8S 004565-32-6 60 5 Benzaldehyde, 2-hydroxy-4-methyl- 136 C8H8O2 000698-27-1 58 ********************************************************************* Peak Number 16 Benzo[b]thiophene, 6-methyl- Concentration Rank 20 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 14.82 8.88 ug/L 202448 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 91 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, 2-methyl- 148 C9H8S 001195-14-8 90 5 3-Methylbenzothiophene 148 C9H8S 001455-18-1 90 ********************************************************************* Peak Number 17 Naphthalene, 1-methyl- Concentration Rank 4 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 15.07 192.00 ug/L 4376830 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Naphthalene, 2-methyl- 142 C11H10 000091-57-6 96 2 Naphthalene, 2-methyl- 142 C11H10 000091-57-6 96 3 Naphthalene, 1-methyl- 142 C11H10 000090-12-0 96 4 Naphthalene, 2-methyl- 142 C11H10 000091-57-6 94 5 Naphthalene, 1-methyl- 142 C11H10 000090-12-0 94 ********************************************************************* Peak Number 18 Biphenyl Concentration Rank 17 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 15.61 13.27 ug/L 302499 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 93 4 Naphthalene, 2-ethenyl- 154 C12H10 000827-54-3 87 5 Biphenyl 154 C12H10 000092-52-4 76 ********************************************************************* Peak Number 19 Naphthalene, 2,6-dimethyl- Concentration Rank 23 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 15.92 8.20 ug/L 187038 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, 2,6-dimethyl- 156 C12H12 000581-42-0 98 3 Naphthalene, 2,7-dimethyl- 156 C12H12 000582-16-1 97 4 Naphthalene, 1,6-dimethyl- 156 C12H12 000575-43-9 97 5 Naphthalene, 1,6-dimethyl- 156 C12H12 000575-43-9 97 ********************************************************************* Peak Number 20 Naphthalene, 1,5-dimethyl- Concentration Rank 19 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 16.07 10.33 ug/L 235440 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, 2,6-dimethyl- 156 C12H12 000581-42-0 97 3 Naphthalene, 2,3-dimethyl- 156 C12H12 000581-40-8 97 4 Naphthalene, 1,4-dimethyl- 156 C12H12 000571-58-4 97 5 Naphthalene, 1,4-dimethyl- 156 C12H12 000571-58-4 97 ********************************************************************* Peak Number 21 Dibenzofuran Concentration Rank 30 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 17.04 3.80 ug/L 86649 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Dibenzofuran 168 C12H8O 000132-64-9 87 2 Dibenzofuran 168 C12H8O 000132-64-9 86 3 9H-Pyrido[3,4-b]indole 168 C11H8N2 000244-63-3 64 4 3,5-Dimethoxybenzyl alcohol 168 C9H12O3 000705-76-0 50 5 2-Amino-6-fluorobenzothiazole 168 C7H5FN2S 000348-40-3 45