| SpectraBase Spectrum ID |
A0pxh87Ro7K |
| Name |
1-(methylthio)-2,3-butanedione |
| Classification |
Alpha-diketones |
| 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 |
132.024500670 u |
| Formula |
C5H8O2S |
| InChI |
InChI=1S/C5H8O2S/c1-4(6)5(7)3-8-2/h3H2,1-2H3 |
| InChIKey |
USBRUYCQQXCPGF-UHFFFAOYSA-N |
| Molecular Weight |
132.177 g/mol |
| Number of Peaks |
14 |
| SMILES |
C(C(C(C)=O)=O)SC |
| SPLASH |
splash10-01ox-9100000000-5e280bdee3d4feaf8315 |
| Source of Spectrum |
FF-30-304-138 (DOI: 10.1002/ffj.3246) |
| Synonyms |
1-(methylthio)butane-2,3-dione |
| Wiley ID |
1787428 |
