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isopentyl methyl sulfide
SpectraBase Compound ID JcclKB7gEog
InChI InChI=1S/C6H14S/c1-6(2)4-5-7-3/h6H,4-5H2,1-3H3
InChIKey ABIKQXWLJOURPN-UHFFFAOYSA-N
Mol Weight 118.24 g/mol
Molecular Formula C6H14S
Exact Mass 118.081622 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H2alf89zt9w
Name Butane, 3-methyl-1-(methylthio)-
CAS Registry Number 13286-90-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H14S
InChI InChI=1S/C6H14S/c1-6(2)4-5-7-3/h6H,4-5H2,1-3H3
InChIKey ABIKQXWLJOURPN-UHFFFAOYSA-N
Molecular Weight 118.238 g/mol
SMILES CSCCC(C)C
SPLASH splash10-074i-9100000000-994d545f02b8b1b5073b
Source of Spectrum JX-2015-6-4471
Synonyms 5-Methyl-2-thiahexane 3-Methyl-1-(methylsulfanyl)butane 3-Methyl-1-(methylthio)butane Methyl isopentyl sulfide Sulfide, isopentyl methyl 3-Methyl-1-methylsulfanylbutane (3-Methylbutyl) methyl sulfide Isopentyl(methyl)sulfane 3-Methyl-1-methylsulfanyl-butane
Wiley ID 1728856