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METHYL-N-BUTYLSULFID
SpectraBase Compound ID 2mo77mjEco8
InChI InChI=1S/C5H12S/c1-3-4-5-6-2/h3-5H2,1-2H3
InChIKey WCXXISMIJBRDQK-UHFFFAOYSA-N
Mol Weight 104.21 g/mol
Molecular Formula C5H12S
Exact Mass 104.065972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2jRICabUYf7
Name Butane, 1-(methylthio)-
CAS Registry Number 628-29-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H12S
InChI InChI=1S/C5H12S/c1-3-4-5-6-2/h3-5H2,1-2H3
InChIKey WCXXISMIJBRDQK-UHFFFAOYSA-N
Molecular Weight 104.211 g/mol
SMILES C(SC)CCC
SPLASH splash10-0nmi-9200000000-f4373fcbadfa3721c543
Source of Spectrum F9-1991-2888-0
Synonyms 1-(Methylsulfanyl)butane 1-(Methylthio)butane 2-Thiahexane Butyl methyl sulfide Butyl methyl sulphide Butyl methyl thioether Methyl butyl sulfide Methyl butyl sulphide Methyl-n-butyl sulfide n-Butyl methyl sulfide Sulfide, butyl methyl EINECS 211-034-2
Wiley ID 1566499