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3-(ETHYLTHIOMETHYL)-1-ISOPROPYLBE
SpectraBase Compound ID FEYvfDHqXVe
InChI InChI=1S/C12H18S/c1-4-13-9-11-6-5-7-12(8-11)10(2)3/h5-8,10H,4,9H2,1-3H3
InChIKey NLXGSRXXESZTMA-UHFFFAOYSA-N
Mol Weight 194.34 g/mol
Molecular Formula C12H18S
Exact Mass 194.112922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 48gQfrYdCOn
Name 3-(Ethylthiomethyl)-1-isopropylbenzene
CAS Registry Number 88315-69-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18S
InChI InChI=1S/C12H18S/c1-4-13-9-11-6-5-7-12(8-11)10(2)3/h5-8,10H,4,9H2,1-3H3
InChIKey NLXGSRXXESZTMA-UHFFFAOYSA-N
Molecular Weight 194.336 g/mol
SMILES CC(C)c1cccc(c1)CSCC
SPLASH splash10-001i-2900000000-76cd1352ffab6550141f
Source of Spectrum LQ-1992-2436-0
Synonyms 1-(ethylsulfanylmethyl)-3-isopropyl-benzene 1-(ethylsulfanylmethyl)-3-propan-2-yl-benzene 1-[(ethylthio)methyl]-3-isopropyl-benzene 1-[(ethylthio)methyl]-3-propan-2-ylbenzene
Wiley ID 150107