Benzo[b]naphtho[2,3-d]thiophene
- Formula: C16H10S
- Molecular weight: 234.316
- IUPAC Standard InChI: InChI=1S/C16H10S/c1-2-6-12-10-16-14(9-11(12)5-1)13-7-3-4-8-15(13)17-16/h1-10H
- IUPAC Standard InChIKey: UWMISBRPSJFHIR-UHFFFAOYSA-N
- CAS Registry Number: 243-46-9
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Other names: Benzo[b]naphto[2,3-d]thiophene; Benzo[b]naphtho[2,3]thiophene; Benzo[a]naphtho[2,3-d]thiophene
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Lee's RI, non-polar column, temperature ramp
Go To: Top, References, Notes
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 | Capillary |
|---|---|---|---|---|---|
| Active phase | Rxi-5 MS | HP-5 | HP-5 MS | DB-5 | SPB-5 |
| Column length (m) | 30. | 60. | 25. | 30. | 30. |
| Carrier gas | Helium | He | He | ||
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.33 | 0.25 | |
| Tstart (C) | 60. | 35. | 70. | 110. | 40. |
| Tend (C) | 340. | 300. | 320. | 325. | 300. |
| Heat rate (K/min) | 5. | 3. | 5. | 10. | 4. |
| Initial hold (min) | 1. | 1. | 2. | ||
| Final hold (min) | 0. | 5. | |||
| I | 395.76 | 395.59 | 395.20 | 395.9 | 395.6 |
| Reference | Zeigler, Schantz, et al., 2012 | Marynowski, Pieta, et al., 2004 | zu Reckendorf, 2003 | Becker and Colmsjö, 1998 | Knobloch and Engewald, 1993 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|
| Active phase | DB-5 | SE-52 | SE-52 | SE-52 |
| Column length (m) | 30. | 19.6 | 20. | 20. |
| Carrier gas | H2 | H2 | H2 | |
| Substrate | ||||
| Column diameter (mm) | 0.25 | 0.32 | 0.30 | 0.30 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | |
| Tstart (C) | 40. | 40. | 40. | 40. |
| Tend (C) | 280. | 280. | 265. | 265. |
| Heat rate (K/min) | 4. | 8. | 4. | 4. |
| Initial hold (min) | 2. | 2. | 2. | |
| Final hold (min) | 5. | |||
| I | 395.59 | 395.79 | 395.61 | 395.97 |
| Reference | Wise, Benner, et al., 1988 | Kong, Lee, et al., 1982 | Vassilaros, Kong, et al., 1982 | Vassilaros, Kong, et al., 1982 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Lee's RI, non-polar column, temperature ramp, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Zeigler, Schantz, et al., 2012
Zeigler, C.; Schantz, M.; Wise, S.; Robbat, A.,
Mass spectra and retention indices for polycyclic aromatic sulfur heterocycles and some alkylated analogs,
Polycyclic Aromatic Compounds, 2012, 32, 2, 154-176, https://doi.org/10.1080/10406638.2011.651679
. [all data]
Marynowski, Pieta, et al., 2004
Marynowski, L.; Pieta, M.; Janeczek, J.,
Composition and source of polycyclic aromatic compounds in deposited dust from selected sites around the Upper Silesia, Poland,
Geol. Q., 2004, 48, 2, 169-180. [all data]
zu Reckendorf, 2003
zu Reckendorf, R.M.,
Pattern change of several polycyclic aromatic furans and analogous thiophenes on oxidative pyrolysis of pitches in flue gases, and the relevance to their quantitative analysis,
Chromatographia, 2003, 58, 1/2, 103-113. [all data]
Becker and Colmsjö, 1998
Becker, G.; Colmsjö, A.,
Gas chromatography-atomic emission detection for quantification of polycyclic aromatic sulfur heterocycles,
Anal. Chim. Acta., 1998, 376, 3, 265-272, https://doi.org/10.1016/S0003-2670(98)00546-7
. [all data]
Knobloch and Engewald, 1993
Knobloch, T.; Engewald, W.,
Identification of some polar polycyclic compounds in emissions from brown-coal-fired residential stoves,
J. Hi. Res. Chromatogr., 1993, 16, 4, 239-242, https://doi.org/10.1002/jhrc.1240160407
. [all data]
Wise, Benner, et al., 1988
Wise, S.A.; Benner, B.A.; Byrd, G.D.; Chesler, S.N.; Rebbert, R.E.; Schantz, M.M.,
Determination of polycyclic aromatic hydrocarbons in a coal tar standard reference material,
Anal. Chem., 1988, 60, 9, 887-894, https://doi.org/10.1021/ac00160a012
. [all data]
Kong, Lee, et al., 1982
Kong, R.C.; Lee, M.L.; Tominaga, Y.; Pratap, R.; Iwao, M.; Castle, R.N.; Wise, S.A.,
Capillary Column Gas Chromatographic Resolution of Isomeric Polycylic Aromatic Sulfur Heterocycles in a Coal Liquid,
J. Chromatogr. Sci., 1982, 20, 11, 502-510, https://doi.org/10.1093/chromsci/20.11.502
. [all data]
Vassilaros, Kong, et al., 1982
Vassilaros, D.L.; Kong, R.C.; Later, D.W.; Lee, M.L.,
Linear retention index system for polycyclic aromatic compounds. Critical evaluation and additional indices,
J. Chromatogr., 1982, 252, 1-20, https://doi.org/10.1016/S0021-9673(01)88394-1
. [all data]
Notes
Go To: Top, Lee's RI, non-polar column, temperature ramp, References
- Symbols used in this document:
Tend Final temperature Tstart Initial temperature - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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