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2-Methyl-1-butanethiol
SpectraBase Compound ID AubZY6kRUxI
InChI InChI=1S/C5H12S/c1-3-5(2)4-6/h5-6H,3-4H2,1-2H3
InChIKey WGQKBCSACFQGQY-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 Iuya5kQcjnu
Name 2-Methyl-butanethiol
CAS Registry Number 1878-18-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H12S
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C5H12S/c1-3-5(2)4-6/h5-6H,3-4H2,1-2H3
InChIKey WGQKBCSACFQGQY-UHFFFAOYSA-N
Molecular Weight 104.211 g/mol
SMILES SCC(CC)C
SPLASH splash10-052g-9000000000-37d5fa89888bc3b76159
Source ex ALDRICH
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Butanethiol<2-methyl->
Wiley ID 1887211