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1,3-Oxathiole, 5-heptyl-4-(methylthio)-
SpectraBase Compound ID 2IBfdZTvC9g
InChI InChI=1S/C11H20OS2/c1-3-4-5-6-7-8-10-11(13-2)14-9-12-10/h3-9H2,1-2H3
InChIKey AUWZSXSNBBPMJF-UHFFFAOYSA-N
Mol Weight 232.4 g/mol
Molecular Formula C11H20OS2
Exact Mass 232.095558 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IRG42mQx0td
Name 1,3-Oxathiole, 5-heptyl-4-(methylthio)-
CAS Registry Number 129206-06-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20OS2
InChI InChI=1S/C11H20OS2/c1-3-4-5-6-7-8-10-11(13-2)14-9-12-10/h3-9H2,1-2H3
InChIKey AUWZSXSNBBPMJF-UHFFFAOYSA-N
Molecular Weight 232.400 g/mol
SMILES C=1(SCOC1CCCCCCC)SC
SPLASH splash10-056s-3910000000-37e6c761ea3dcac7c3ae
Source of Spectrum F-46-1786-2
Synonyms 4-Methylthio-5-heptyl-1,3-oxathiolene 5-Heptyl-1,3-oxathiol-4-yl methyl sulfide 5-Heptyl-4-(methylsulfanyl)-1,3-oxathiole
Wiley ID 1233472