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Benzene, [2-[(1-methylethyl)thio]ethyl]-
SpectraBase Compound ID 64QXuMlDpGE
InChI InChI=1S/C11H16S/c1-10(2)12-9-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
InChIKey MJLYFFRRKQGUDV-UHFFFAOYSA-N
Mol Weight 180.31 g/mol
Molecular Formula C11H16S
Exact Mass 180.097272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LFYrjjAuN2N
Name Benzene, [2-[(1-methylethyl)thio]ethyl]-
CAS Registry Number 54576-42-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16S
InChI InChI=1S/C11H16S/c1-10(2)12-9-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
InChIKey MJLYFFRRKQGUDV-UHFFFAOYSA-N
Molecular Weight 180.309 g/mol
SMILES CC(C)SCCc1ccccc1
SPLASH splash10-000f-9100000000-54ff774ad31e2a679004
Source of Spectrum AA-0-1229-1
Synonyms [2-(Isopropylsulfanyl)ethyl]benzene 2-(1-Methylethylthio)ethylbenzene 4-Methyl-1-phenyl-3-thiapentane 2-(Isopropylthio)ethylbenzene 2-(propan-2-ylthio)ethylbenzene 2-Propan-2-ylsulfanylethylbenzene Isopropyl(phenethyl)sulfane 2-Isopropylsulfanylethylbenzene
Wiley ID 18223