| SpectraBase Compound ID | FjHEU1iA8Ja |
|---|---|
| InChI | InChI=1S/C8H16OS/c1-4-5-6-8(10-3)7(2)9/h8H,4-6H2,1-3H3 |
| InChIKey | HZEAHENEGUCVJX-UHFFFAOYSA-N |
| Mol Weight | 160.27 g/mol |
| Molecular Formula | C8H16OS |
| Exact Mass | 160.092186 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CJP2YpTSQol |
|---|---|
| Name | 3-methylthio-2-heptanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H16OS |
| InChI | InChI=1S/C8H16OS/c1-4-5-6-8(10-3)7(2)9/h8H,4-6H2,1-3H3 |
| InChIKey | HZEAHENEGUCVJX-UHFFFAOYSA-N |
| Ionization Type | EI |
| Molecular Weight | 160.275 g/mol |
| SMILES | CC(C(CCCC)SC)=O |
| SPLASH | splash10-02t9-9500000000-73d0c26d2d99f418d320 |
| Source of Spectrum | JP2010100569A |
| Wiley ID | 1841957 |