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2-[2-[(Methylthio)methyl]-3-butenyl]cyclohexanone
SpectraBase Compound ID Epxth9OZcY1
InChI InChI=1S/C12H20OS/c1-3-10(9-14-2)8-11-6-4-5-7-12(11)13/h3,10-11H,1,4-9H2,2H3
InChIKey DRMXFSOYLQGPMR-UHFFFAOYSA-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 8WSu3ZZ6H5
Name 2-[2-[(Methylthio)methyl]-3-butenyl]cyclohexanone
CAS Registry Number 83720-11-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20OS
InChI InChI=1S/C12H20OS/c1-3-10(9-14-2)8-11-6-4-5-7-12(11)13/h3,10-11H,1,4-9H2,2H3
InChIKey DRMXFSOYLQGPMR-UHFFFAOYSA-N
Molecular Weight 212.351 g/mol
SMILES C1(C(CC(C=C)CSC)CCCC1)=O
SPLASH splash10-03di-7920000000-97b1d4eea84f8238a0f6
Source of Spectrum J-48-22-0
Synonyms 2-{2-[(methylsulfanyl)methyl]-3-butenyl}cyclohexanone
Wiley ID 1211430