| SpectraBase Compound ID | B3Trg2hACLi |
|---|---|
| InChI | InChI=1S/C8H14O3S/c1-7(9)12-6-4-2-3-5-8(10)11/h2-6H2,1H3,(H,10,11) |
| InChIKey | PIFIISOIFYMVLS-UHFFFAOYSA-N |
| Mol Weight | 190.26 g/mol |
| Molecular Formula | C8H14O3S |
| Exact Mass | 190.066365 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2edoJzxI0W |
|---|---|
| Name | 6-(Acetylthio)hexanoic acid |
| Alternate Name(s) | 6-Ethanoylsulfanylhexanoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H14O3S |
| InChI | InChI=1S/C8H14O3S/c1-7(9)12-6-4-2-3-5-8(10)11/h2-6H2,1H3,(H,10,11) |
| InChIKey | PIFIISOIFYMVLS-UHFFFAOYSA-N |
| Molecular Weight | 190.257 g/mol |
| SMILES | OC(CCCCCSC(=O)C)=O |
| SPLASH | splash10-0kai-4900000000-8860c153e6068d7880b9 |
| Source of Spectrum | KC-0-1515-20 |
| Wiley ID | 821489 |