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(Z)-4-(2-(methylthiomethylene)cyclohexyl)butan-2-one
SpectraBase Compound ID 83Hp6pKFD3X
InChI InChI=1S/C12H20OS/c1-10(13)7-8-11-5-3-4-6-12(11)9-14-2/h9,11H,3-8H2,1-2H3/b12-9-
InChIKey ITPNFFBKZULMCK-XFXZXTDPSA-N
Mol Weight 212.35 g/mol
Molecular Formula C12H20OS
Exact Mass 212.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FxqlWeGgGnF
Name (Z)-4-(2-(methylthiomethylene)cyclohexyl)butan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20OS
InChI InChI=1S/C12H20OS/c1-10(13)7-8-11-5-3-4-6-12(11)9-14-2/h9,11H,3-8H2,1-2H3/b12-9-
InChIKey ITPNFFBKZULMCK-XFXZXTDPSA-N
Literature Reference DOI 10.1002/hc.520060205
Molecular Weight 212.351 g/mol
SMILES CC(CCC1CCCC\C1=C/SC)=O
SPLASH splash10-01p6-6910000000-1cfef1e3dc2770b48834
Source of Spectrum HAC-6-112-(Z)_8an
Synonyms (Z)-4-(2-((methylthio)methylene)cyclohexyl)butan-2-one
Wiley ID 1799662