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3-acetylthio-2-hexanone
SpectraBase Compound ID 8ZuWQKCwMmQ
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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HO7v3Uz3JkO
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