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2-Butanethiol
SpectraBase Compound ID IbzI99Jwcbh
InChI InChI=1S/C4H10S/c1-3-4(2)5/h4-5H,3H2,1-2H3
InChIKey LOCHFZBWPCLPAN-UHFFFAOYSA-N
Mol Weight 90.18 g/mol
Molecular Formula C4H10S
Exact Mass 90.050321 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1jaaHuq62E
Name sec-Butyl thioalcohol
CAS Registry Number 513-53-1
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 90.050321496 u
Formula C4H10S
InChI InChI=1S/C4H10S/c1-3-4(2)5/h4-5H,3H2,1-2H3
InChIKey LOCHFZBWPCLPAN-UHFFFAOYSA-N
Molecular Weight 90.184 g/mol
Number of Peaks 50
RI1 683
RI2 378
SMILES SC(C)CC
SPLASH splash10-06r6-9000000000-872cf709207cfcaeab64
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 2-Butanethiol
Wiley ID LM_FFNSC3_3134