| SpectraBase Compound ID | 2R0ivzLepvo |
|---|---|
| InChI | InChI=1S/C7H14O3S/c1-4-10-7(9)6(11-3)5(2)8/h5-6,8H,4H2,1-3H3 |
| InChIKey | HFEDWPOEYLSJNY-UHFFFAOYSA-N |
| Mol Weight | 178.25 g/mol |
| Molecular Formula | C7H14O3S |
| Exact Mass | 178.066365 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HaSQOHxLCpZ |
|---|---|
| Name | BUTANOIC ACID, 3-HYDROXY-2-(METHYLTHIO)-, ETHYL ESTER |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C7H14O3S |
| InChI | InChI=1S/C7H14O3S/c1-4-10-7(9)6(11-3)5(2)8/h5-6,8H,4H2,1-3H3 |
| InChIKey | HFEDWPOEYLSJNY-UHFFFAOYSA-N |
| Molecular Weight | 178.0660 |
| SMILES | OC(C(C(OCC)=O)SC)C |
| SPLASH | splash10-0a5i-9500000000-ff1cf39ec571f96d666c |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |