Library Search Compound Report Data Path : W:\HPCHEM1\MSVOA_U\DATA\VU050718\ Data File : VU023722.D Acq On : 07 May 2018 19:02 Operator : MD/SY Sample : J2725-14 Misc : 5.0mL/MSVOA_U/WATER ALS Vial : 20 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 3 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 1.33 46.83 ug/L 802357 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 Sulfur dioxide 64 O2S 007446-09-5 5 ********************************************************************* Peak Number 2 Indane Concentration Rank 7 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 11.77 15.66 ug/L 334454 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 Indane 118 C9H10 000496-11-7 87 5 Tetracyclo[3.3.1.0(2,8).0(4,6)]-... 118 C9H10 1000191-13-7 80 ********************************************************************* Peak Number 3 Indene Concentration Rank 10 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 11.99 8.26 ug/L 176347 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Indene 116 C9H8 000095-13-6 95 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-propynyl- 116 C9H8 000673-32-5 91 ********************************************************************* Peak Number 4 Benzene, 1-ethenyl-3-ethyl- Concentration Rank 9 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 12.36 9.37 ug/L 200174 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Benzene, 1-ethenyl-3-ethyl- 132 C10H12 007525-62-4 87 2 Indan, 1-methyl- 132 C10H12 000767-58-8 87 3 Indan, 1-methyl- 132 C10H12 000767-58-8 81 4 Benzene, 2-butenyl- 132 C10H12 001560-06-1 80 5 Benzene, (2-methylcyclopropyl)- 132 C10H12 1000327-39-0 80 ********************************************************************* Peak Number 5 Benzofuran, 2-methyl- Concentration Rank 15 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 12.60 5.06 ug/L 108049 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 3-Phenyl-2-propyn-1-ol 132 C9H8O 001504-58-1 94 3 Benzofuran, 7-methyl- 132 C9H8O 017059-52-8 94 4 Benzofuran, 2-methyl- 132 C9H8O 004265-25-2 94 5 Cinnamaldehyde, (E)- 132 C9H8O 014371-10-9 91 ********************************************************************* Peak Number 6 Benzofuran, 7-methyl- Concentration Rank 11 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 12.71 7.93 ug/L 169392 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 93 3 Benzofuran, 2-methyl- 132 C9H8O 004265-25-2 91 4 2-Propenal, 3-phenyl- 132 C9H8O 000104-55-2 87 5 Benzofuran, 2-methyl- 132 C9H8O 004265-25-2 87 ********************************************************************* Peak Number 7 Benzo[c]thiophene Concentration Rank 6 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 13.86 15.77 ug/L 336743 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 Cyclopenta[c]thiapyran 134 C8H6S 000270-63-3 94 4 Benzo[b]thiophene 134 C8H6S 000095-15-8 94 5 Benzo[b]thiophene 134 C8H6S 000095-15-8 91 ********************************************************************* Peak Number 8 Benzo[b]thiophene, 2,3-dihy... Concentration Rank 18 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 14.54 3.84 ug/L 82003 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 93 3 Benzo[b]thiophene, 2,3-dihydro- 136 C8H8S 004565-32-6 64 4 Benzaldehyde, 4-methoxy- 136 C8H8O2 000123-11-5 58 5 4-Hydroxy-2-methylbenzaldehyde 136 C8H8O2 041438-18-0 58 ********************************************************************* Peak Number 9 3-Methylbenzothiophene Concentration Rank 16 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 14.82 4.35 ug/L 92856 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 3-Methylbenzothiophene 148 C9H8S 001455-18-1 91 2 Benzo[b]thiophene, 2-methyl- 148 C9H8S 001195-14-8 91 3 Benzo[b]thiophene, 4-methyl- 148 C9H8S 014315-11-8 91 4 Benzo[b]thiophene, 2-methyl- 148 C9H8S 001195-14-8 91 5 Benzo[b]thiophene, 6-methyl- 148 C9H8S 016587-47-6 91 ********************************************************************* Peak Number 10 Naphthalene, 1-methyl- Concentration Rank 5 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 15.07 16.48 ug/L 351862 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 11 Biphenyl Concentration Rank 13 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 15.61 5.86 ug/L 125072 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Biphenyl 154 C12H10 000092-52-4 87 2 Naphthalene, 2-ethenyl- 154 C12H10 000827-54-3 87 3 Biphenyl 154 C12H10 000092-52-4 81 4 Naphtho[1,2-c]thiophene, 1,3-dih... 202 C12H10OS 031739-49-8 64 5 1-(2,2-Difluoroethenyl)-4-methyl... 154 C9H8F2 1000305-64-2 59 ********************************************************************* Peak Number 12 Naphthalene, 1,3-dimethyl- Concentration Rank 17 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 16.44 3.86 ug/L 82327 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, 1,2-dimethyl- 156 C12H12 000573-98-8 96 3 Naphthalene, 1,4-dimethyl- 156 C12H12 000571-58-4 96 4 Naphthalene, 1,3-dimethyl- 156 C12H12 000575-41-7 96 5 Naphthalene, 2,3-dimethyl- 156 C12H12 000581-40-8 96 ********************************************************************* Peak Number 13 1-Isopropenylnaphthalene Concentration Rank 14 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 16.92 5.30 ug/L 113111 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 1-Isopropenylnaphthalene 168 C13H12 001855-47-6 87 2 2,4(1H,3H)-Pyrimidinedione, 5-(1... 168 C8H12N2O2 017432-97-2 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 52 5 Benzene, 2-chloro-1-methyl-4-(1-... 168 C10H13Cl 004395-79-3 50 ********************************************************************* Peak Number 14 Dibenzofuran Concentration Rank 12 R.T. EstConc Area Relative to ISTD R.T. --------------------------------------------------------------------- 17.04 6.84 ug/L 146173 1,4-Dichlorobenzene-d4 11.49 Hit# of 5 Tentative ID MW MolForm CAS# Qual --------------------------------------------------------------------- 1 Dibenzofuran 168 C12H8O 000132-64-9 90 2 Dibenzofuran 168 C12H8O 000132-64-9 80 3 9H-Pyrido[3,4-b]indole 168 C11H8N2 000244-63-3 64 4 Ethyl 9H-pyrido(3,4-b)indole-3-c... 240 C14H12N2O2 074214-62-3 59 5 Naphtho[2,1-d]imidazole 168 C11H8N2 000233-53-4 59