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[1-(t-Butyl)-3-(3'-isopropyl-5'-methylcyclohexyl)allyl] (3"-Butenyl) Sulfide
SpectraBase Compound ID HmGQfNmCyW
InChI InChI=1S/C21H38S/c1-8-9-12-22-20(21(5,6)7)11-10-18-13-17(4)14-19(15-18)16(2)3/h8,10-11,16-20H,1,9,12-15H2,2-7H3/b11-10+
InChIKey UXRGEQHRBJTFSD-ZHACJKMWSA-N
Mol Weight 322.6 g/mol
Molecular Formula C21H38S
Exact Mass 322.269422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3hZPbbx4Nuj
Name [1-(t-Butyl)-3-(3'-isopropyl-5'-methylcyclohexyl)allyl] (3"-Butenyl) Sulfide
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H38S
InChI InChI=1S/C21H38S/c1-8-9-12-22-20(21(5,6)7)11-10-18-13-17(4)14-19(15-18)16(2)3/h8,10-11,16-20H,1,9,12-15H2,2-7H3/b11-10+
InChIKey UXRGEQHRBJTFSD-ZHACJKMWSA-N
Molecular Weight 322.595 g/mol
SMILES C1(\C=C\C(C(C)(C)C)SCCC=C)CC(C(C)C)CC(C1)C
SPLASH splash10-00or-0981000000-c0d26def96f9bcd7350a
Source of Spectrum I-85-615-34
Synonyms 1-[(1E)-3-(3-butenylsulfanyl)-4,4-dimethyl-1-pentenyl]-3-isopropyl-5-methylcyclohexane 3-Butenyl (2E)-1-tert-butyl-3-(3-isopropyl-5-methylcyclohexyl)-2-propenyl sulfide
Wiley ID 1584878