Cyano-3,4-epithiobutane
- Formula: C5H7NS
- Molecular weight: 113.181
- IUPAC Standard InChI: InChI=1S/C5H7NS/c6-3-1-2-5-4-7-5/h5H,1-2,4H2
- IUPAC Standard InChIKey: ZAGXORSINWAUSP-UHFFFAOYSA-N
- CAS Registry Number: 54096-45-6
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: Valeronitrile, 4,5-epithio-; 1-Cyano-3,4-epithiobutane; 4,5-Epithiovaleronitrile; 3-(Thiiran-2-yl)propanenitrile; 3,4-Epoxythiobutyl cyanide
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Normal alkane RI, non-polar column, temperature ramp
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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 |
|---|---|
| Active phase | HP-1 |
| Column length (m) | 50. |
| Carrier gas | Helium |
| Substrate | |
| Column diameter (mm) | 0.20 |
| Phase thickness (μm) | 0.33 |
| Tstart (C) | 60. |
| Tend (C) | 250. |
| Heat rate (K/min) | 2. |
| Initial hold (min) | |
| Final hold (min) | 20. |
| I | 1075. |
| Reference | Breme, Langle, et al., 2008 |
| Comment | MSDC-RI |
References
Go To: Top, Normal alkane 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.
Breme, Langle, et al., 2008
Breme, K.; Langle, S.; Fernandez, X.; Meierhenrich, U.J.; Brevard, H.; Joulain, D.,
Character impact odorants from Brassicaceae by aroma extracts dilution analysis (AEDA): Brassica cretica and Brassica insularis,
Flavour Fragr. J., 2008, 24, 2, 88-93, https://doi.org/10.1002/ffj.1912
. [all data]
Notes
Go To: Top, Normal alkane 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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