| SpectraBase Spectrum ID |
2QWryAoRSS9 |
| Name |
CARBOPHENOTHIONE |
| CAS Registry Number |
786-19-6 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
341.973857973 u |
| Formula |
C11H16ClO2PS3 |
| InChI |
InChI=1S/C11H16ClO2PS3/c1-3-13-15(16,14-4-2)18-9-17-11-7-5-10(12)6-8-11/h5-8H,3-4,9H2,1-2H3 |
| InChIKey |
VEDTXTNSFWUXGQ-UHFFFAOYSA-N |
| Molecular Weight |
342.854 g/mol |
| Nominal Mass |
342 u |
| Number of Peaks |
113 |
| SMILES |
c1cc(ccc1SCSP(OCC)(OCC)=S)Cl |
| SPLASH |
splash10-052b-5901000000-f7e72d8ee458ad61127f |
| Source of Spectrum |
Dr. Rolf Kuehnle |
| Synonyms |
S-{[(4-chlorophenyl)sulfanyl]methyl} O,O-diethyl dithiophosphate |
| Technique |
GC/MS |
| Wiley ID |
WID_MSPA_3609 |
