| SpectraBase Spectrum ID |
99LLG3aCb6Y |
| Name |
BUTANOIC ACID, 3-(ETHYLTHIO)- |
| 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 |
148.055800798 u |
| Formula |
C6H12O2S |
| InChI |
InChI=1S/C6H12O2S/c1-3-9-5(2)4-6(7)8/h5H,3-4H2,1-2H3,(H,7,8) |
| InChIKey |
CFYGRPLJFXVZKY-UHFFFAOYSA-N |
| Molecular Weight |
148.220 g/mol |
| Nominal Mass |
148 u |
| Number of Peaks |
62 |
| SMILES |
CCSC(CC(O)=O)C |
| SPLASH |
splash10-03dv-9200000000-0b3c3964f7e2b241f8df |
| Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |
| Wiley ID |
MVX000855 |
