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1-((2-Hexyl-4,5-dimethyl-1,4-cyclohexadien-1-yl)sulfanyl)-4-methoxybenzene
SpectraBase Compound ID GHQf4JTHsQI
InChI InChI=1S/C21H30OS/c1-5-6-7-8-9-18-14-16(2)17(3)15-21(18)23-20-12-10-19(22-4)11-13-20/h10-13H,5-9,14-15H2,1-4H3
InChIKey CHLWAISFRFQBBG-UHFFFAOYSA-N
Mol Weight 330.53 g/mol
Molecular Formula C21H30OS
Exact Mass 330.201737 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 56LnPkjSRIE
Name 1-((2-Hexyl-4,5-dimethyl-1,4-cyclohexadien-1-yl)sulfanyl)-4-methoxybenzene
Alternate Name(s) 4-[(2-hexyl-4,5-dimethyl-1,4-cyclohexadien-1-yl)sulfanyl]phenyl methyl ether
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30OS
InChI InChI=1S/C21H30OS/c1-5-6-7-8-9-18-14-16(2)17(3)15-21(18)23-20-12-10-19(22-4)11-13-20/h10-13H,5-9,14-15H2,1-4H3
InChIKey CHLWAISFRFQBBG-UHFFFAOYSA-N
Molecular Weight 330.530 g/mol
SMILES c1(ccc(cc1)OC)SC1=C(CC(=C(C1)C)C)CCCCCC
SPLASH splash10-001l-0907000000-e9bedb0fe15075926cd2
Source of Spectrum F-69-630-2
Wiley ID 1594605