SpectraBase Compound ID | 8ZuWQKCwMmQ |
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InChI | InChI=1S/C8H14O2S/c1-4-5-8(6(2)9)11-7(3)10/h8H,4-5H2,1-3H3 |
InChIKey | NTWZWAJXHLLTFE-UHFFFAOYSA-N |
Mol Weight | 174.26 g/mol |
Molecular Formula | C8H14O2S |
Exact Mass | 174.071451 g/mol |
SpectraBase Spectrum ID | HO7v3Uz3JkO |
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Name | 3-acetylthio-2-hexanone |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C8H14O2S |
InChI | InChI=1S/C8H14O2S/c1-4-5-8(6(2)9)11-7(3)10/h8H,4-5H2,1-3H3 |
InChIKey | NTWZWAJXHLLTFE-UHFFFAOYSA-N |
Ionization Type | EI |
Molecular Weight | 174.258 g/mol |
SMILES | CC(C(CCC)SC(=O)C)=O |
SPLASH | splash10-000x-9400000000-d9bb5ee2bc7d58e57c87 |
Source of Spectrum | JP2010100570A |
Wiley ID | 1841993 |