Benzene, 1,3,5-trichloro-2-methoxy-
- Formula: C7H5Cl3O
- Molecular weight: 211.473
- IUPAC Standard InChI: InChI=1S/C7H5Cl3O/c1-11-7-5(9)2-4(8)3-6(7)10/h2-3H,1H3
- IUPAC Standard InChIKey: WCVOGSZTONGSQY-UHFFFAOYSA-N
- CAS Registry Number: 87-40-1
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
View 3d structure (requires JavaScript / HTML 5) - Other names: Anisole, 2,4,6-trichloro-; Methyl 2,4,6-trichlorophenyl ether; Tyrene; 2,4,6-Trichloroanisole; 1,3,5-Trichloro-2-methoxybenzene
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Normal alkane RI, non-polar column, custom temperature program
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
| Column type | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|
| Active phase | DB-5 | CP Sil 2 | OV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc. | OV-1 |
| Column length (m) | 30. | 55. | 50. | 50. |
| Carrier gas | Hydrogen | N2 | Hydrogen | Hydrogen |
| Substrate | ||||
| Column diameter (mm) | 0.32 | 0.25 | 0.32 | 0.32 |
| Phase thickness (μm) | 0.50 | 0.25 | ||
| Program | 40 0C 2 0C/min -> 12 0C/min -> 105 0C 6 0C/min -> 220 0C (20 min) | 40C(3min) => 20C/min => 80C => 2C/min => 240C(45min) | not specified | not specified |
| I | 1330. | 1322. | 1302. | 1302. |
| Reference | Prat, Trias, et al., 2009 | Fuhrer, Deissler, et al., 1997 | Waggott and Davies, 1984 | Waggott and Davies, 1984 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, non-polar column, custom temperature program, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Prat, Trias, et al., 2009
Prat, C.; Trias, R.; Cullere, L.; Escudero, A.; Antico, E.; BAneras, L.,
Off-odor compounds produced in cork by isolated bacteria and fungi: a gas chromatography - mass spectrometry and gas chromatography - olfactometry study,
J. Agric. Food Chem., 2009, 57, 16, 7473-7479, https://doi.org/10.1021/jf900723s
. [all data]
Fuhrer, Deissler, et al., 1997
Fuhrer, U.; Deissler, A.; Schreitmuller, J.; Ballschmiter, K.,
Analysis of Halogenated Methoxybenzenes and Hexachlorobenzene (HCB) in the Picogram m-3 Range in Marine Air,
Chromatographia, 1997, 45, 1, 414-427, https://doi.org/10.1007/BF02505594
. [all data]
Waggott and Davies, 1984
Waggott, A.; Davies, I.W.,
Identification of organic pollutants using linear temperature programmed retention indices (LTPRIs) - Part II, 1984, retrieved from http://dwi.defra.gov.uk/research/completed-research/reports/dwi0383.pdf. [all data]
Notes
Go To: Top, Normal alkane RI, non-polar column, custom temperature program, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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