| SpectraBase Compound ID | 7Y4O6xSaEFF |
|---|---|
| InChI | InChI=1S/C6H12O2S/c1-3-5(9-2)4-6(7)8/h5H,3-4H2,1-2H3,(H,7,8) |
| InChIKey | OPEITBWCEQGRJP-UHFFFAOYSA-N |
| Mol Weight | 148.22 g/mol |
| Molecular Formula | C6H12O2S |
| Exact Mass | 148.055801 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JgCdmi6y8Fh |
|---|---|
| Name | 3-(methylthio)pentanoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H12O2S |
| InChI | InChI=1S/C6H12O2S/c1-3-5(9-2)4-6(7)8/h5H,3-4H2,1-2H3,(H,7,8) |
| InChIKey | OPEITBWCEQGRJP-UHFFFAOYSA-N |
| Molecular Weight | 148.220 g/mol |
| SMILES | OC(CC(SC)CC)=O |
| SPLASH | splash10-03dv-9200000000-86c8249f46c1b6ca820d |
| Source of Spectrum | VC-1981-881-0 |
| Synonyms | 3-(methylsulfanyl)pentanoic acid 3-Methylsulfanylpentanoic acid |
| Wiley ID | 1145183 |