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1-Hexyl-4,5-dimethyl-2-(phenylsulfanyl)benzene
SpectraBase Compound ID LMKzpmXsOxj
InChI InChI=1S/C20H26S/c1-4-5-6-8-11-18-14-16(2)17(3)15-20(18)21-19-12-9-7-10-13-19/h7,9-10,12-15H,4-6,8,11H2,1-3H3
InChIKey GDUTZTTVEZRZBF-UHFFFAOYSA-N
Mol Weight 298.49 g/mol
Molecular Formula C20H26S
Exact Mass 298.175522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4embsInps8
Name 1-Hexyl-4,5-dimethyl-2-(phenylsulfanyl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26S
InChI InChI=1S/C20H26S/c1-4-5-6-8-11-18-14-16(2)17(3)15-20(18)21-19-12-9-7-10-13-19/h7,9-10,12-15H,4-6,8,11H2,1-3H3
InChIKey GDUTZTTVEZRZBF-UHFFFAOYSA-N
Molecular Weight 298.488 g/mol
SMILES c1(c(cc(c(c1)C)C)Sc1ccccc1)CCCCCC
SPLASH splash10-002b-0090000000-455ff484543acb80d5c7
Source of Spectrum F-69-630-4
Synonyms 2-Hexyl-4,5-dimethylphenyl phenyl sulfide 1-Hexyl-4,5-dimethyl-2-phenylsulfanylbenzene 1-Hexyl-4,5-dimethyl-2-phenylsulfanyl-benzene
Wiley ID 1594603