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rac-4-Mercapto-2-hexanone
SpectraBase Compound ID KVWK2FQwK07
InChI InChI=1S/C6H12OS/c1-3-6(8)4-5(2)7/h6,8H,3-4H2,1-2H3
InChIKey YOCURLWEIKERNU-UHFFFAOYSA-N
Mol Weight 132.22 g/mol
Molecular Formula C6H12OS
Exact Mass 132.060886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GIxVOgJGIm2
Name rac-4-Mercapto-2-hexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12OS
InChI InChI=1S/C6H12OS/c1-3-6(8)4-5(2)7/h6,8H,3-4H2,1-2H3
InChIKey YOCURLWEIKERNU-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ffj.3228
Molecular Weight 132.221 g/mol
SMILES SC(CC(C)=O)CC
SPLASH splash10-0006-9000000000-acc00f0f1babc25d1eaa
Source of Spectrum FF-30-173-2
Synonyms 4-Mercaptohexan-2-one
Wiley ID 1787425