Library Search Compound Report Data Path : W:\HPCHEM1\MSVOA_U\DATA\VU050718\ Data File : VU023723.D Acq On : 07 May 2018 19:29 Operator : MD/SY Sample : J2725-15 Misc : 5.0mL/MSVOA_U/WATER ALS Vial : 21 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 4 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 1.29 26.99 ug/L 472191 1,4-Difluorobenzene 5.89 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Sulfur dioxide 64 O2S 007446-09-5 83 2 Aminomethanesulfonic acid 111 CH5NO3S 013881-91-9 74 3 L-Alanine, 3-sulfo- 169 C3H7NO5S 000498-40-8 9 4 Aminomethanesulfonic acid 111 CH5NO3S 013881-91-9 9 5 Ethene, 1,1-difluoro- 64 C2H2F2 000075-38-7 4 ********************************************************************* Peak Number 2 Indane Concentration Rank 7 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 11.77 15.07 ug/L 333175 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 91 4 Indane 118 C9H10 000496-11-7 90 5 Benzene, 1-ethenyl-4-methyl- 118 C9H10 000622-97-9 74 ********************************************************************* Peak Number 3 Indene Concentration Rank 12 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 11.99 7.52 ug/L 166138 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 95 3 Indene 116 C9H8 000095-13-6 94 4 Benzene, 1-propynyl- 116 C9H8 000673-32-5 91 5 Benzene, 1-ethynyl-4-methyl- 116 C9H8 000766-97-2 91 ********************************************************************* Peak Number 4 Indan, 1-methyl- Concentration Rank 10 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 12.36 9.53 ug/L 210705 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 87 3 Benzene, 1-ethenyl-4-ethyl- 132 C10H12 003454-07-7 87 4 Indan, 1-methyl- 132 C10H12 000767-58-8 81 5 Benzene, (2-methyl-1-propenyl)- 132 C10H12 000768-49-0 78 ********************************************************************* Peak Number 5 Benzofuran, 2-methyl- Concentration Rank 15 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 12.60 5.12 ug/L 113165 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, 2-methyl- 132 C9H8O 004265-25-2 91 3 2-Propenal, 3-phenyl- 132 C9H8O 000104-55-2 90 4 2-Propenal, 3-phenyl- 132 C9H8O 000104-55-2 90 5 Cinnamaldehyde, (E)- 132 C9H8O 014371-10-9 90 ********************************************************************* Peak Number 6 Benzo[c]thiophene Concentration Rank 5 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 13.86 15.65 ug/L 346016 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 7 Benzo[b]thiophene, 2,3-dihy... Concentration Rank 18 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 14.54 3.61 ug/L 79840 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[b]thiophene, 2,3-dihydro- 136 C8H8S 004565-32-6 76 3 Benzo[c]thiophene, 1,3-dihydro- 136 C8H8S 002471-92-3 70 4 Benzaldehyde, 2-hydroxy-4-methyl- 136 C8H8O2 000698-27-1 53 5 Benzene, (ethenylthio)- 136 C8H8S 001822-73-7 53 ********************************************************************* Peak Number 8 Benzo[b]thiophene, 2-methyl- Concentration Rank 17 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 14.82 4.58 ug/L 101215 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 94 2 Benzo[b]thiophene, 2-methyl- 148 C9H8S 001195-14-8 94 3 Benzo[b]thiophene, 6-methyl- 148 C9H8S 016587-47-6 94 4 Benzo[b]thiophene, 5-methyl- 148 C9H8S 014315-14-1 91 5 3-Methylbenzothiophene 148 C9H8S 001455-18-1 90 ********************************************************************* Peak Number 9 Naphthalene, 1-methyl- Concentration Rank 6 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 15.07 15.29 ug/L 337896 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 93 5 Naphthalene, 1-methyl- 142 C11H10 000090-12-0 93 ********************************************************************* Peak Number 10 Biphenyl Concentration Rank 14 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 15.61 6.17 ug/L 136347 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 91 3 Naphthalene, 2-ethenyl- 154 C12H10 000827-54-3 83 4 Biphenyl 154 C12H10 000092-52-4 76 5 Biphenyl 154 C12H10 000092-52-4 70 ********************************************************************* Peak Number 11 Naphthalene, 1,3-dimethyl- Concentration Rank 16 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 16.44 4.76 ug/L 105120 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 97 3 Naphthalene, 1,2-dimethyl- 156 C12H12 000573-98-8 96 4 Naphthalene, 1,4-dimethyl- 156 C12H12 000571-58-4 96 5 Naphthalene, 1,3-dimethyl- 156 C12H12 000575-41-7 95 ********************************************************************* Peak Number 12 Biphenylene Concentration Rank 19 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 16.53 3.06 ug/L 67724 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Biphenylene 152 C12H8 000259-79-0 90 2 Biphenylene 152 C12H8 000259-79-0 90 3 Acenaphthylene 152 C12H8 000208-96-8 87 4 Acenaphthylene 152 C12H8 000208-96-8 87 5 Acenaphthylene 152 C12H8 000208-96-8 80 ********************************************************************* Peak Number 13 1-Isopropenylnaphthalene Concentration Rank 13 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 16.92 6.77 ug/L 149555 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 1-Isopropenylnaphthalene 168 C13H12 001855-47-6 90 2 Naphthalene, 1-(2-propenyl)- 168 C13H12 002489-86-3 80 3 Benzene, [1-(2,4-cyclopentadien-... 168 C13H12 002320-32-3 72 4 Ethanone, 1-(2,4,6-trihydroxyphe... 168 C8H8O4 000480-66-0 52 5 Ethanone, 1-(2,4,6-trihydroxyphe... 168 C8H8O4 000480-66-0 50 ********************************************************************* Peak Number 14 Dibenzofuran Concentration Rank 9 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 17.04 12.72 ug/L 281191 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 90 3 Naphtho[2,1-d]imidazole 168 C11H8N2 000233-53-4 59 4 Pyridine, 2-(phenylmethyl)- 169 C12H11N 000101-82-6 53 5 3,5-Dimethoxybenzyl alcohol 168 C9H12O3 000705-76-0 50