SpectraBase Compound ID | 5H7fE3Q7zmL |
---|---|
InChI | InChI=1S/C9H10O2S/c10-9(11)6-7-12-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11) |
InChIKey | IGPROYLOGZTOAM-UHFFFAOYSA-N |
Mol Weight | 182.24 g/mol |
Molecular Formula | C9H10O2S |
Exact Mass | 182.040151 g/mol |
SpectraBase Spectrum ID | AFDhtIjiaK1 |
---|---|
Name | PROPANOIC ACID, 3-(PHENYLTHIO)- |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C9H10O2S |
InChI | InChI=1S/C9H10O2S/c10-9(11)6-7-12-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11) |
InChIKey | IGPROYLOGZTOAM-UHFFFAOYSA-N |
Molecular Weight | 182.0399 |
SMILES | OC(=O)CCSc1ccccc1 |
SPLASH | splash10-03l0-9800000000-b623eb81313d3e1757ed |
Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |