| SpectraBase Spectrum ID |
3r7sG9TzTYL |
| Name |
4-methylsulphonylbut-3-enyl isothiocyanate |
| 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 |
191.007470880 u |
| Formula |
C6H9NO2S2 |
| InChI |
InChI=1S/C6H9NO2S2/c1-11(8,9)5-3-2-4-7-6-10/h3,5H,2,4H2,1H3 |
| InChIKey |
MRYHGPUCPMWCPH-UHFFFAOYSA-N |
| Instrument Name |
AEI MS-902 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jsfa.2740310606 |
| Molecular Weight |
191.263 g/mol |
| Number of Peaks |
12 |
| SMILES |
CS(C=CCCN=C=S)(=O)=O |
| SPLASH |
splash10-00ds-9000000000-da006c1237bacb114899 |
| Source of Spectrum |
SFA-31-551-21 (DOI: 10.1002/jsfa.2740310606) |
| Wiley ID |
1856622 |
