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1,2-Heptadien-4-ol, 6-methyl-1-[(4-methylphenyl)sulfonyl]-, (R*,S*)-(.+-.)-
SpectraBase Compound ID 8rfnCCHoVt2
InChI InChI=1S/C15H20O3S/c1-12(2)11-14(16)5-4-10-19(17,18)15-8-6-13(3)7-9-15/h5-10,12,14,16H,11H2,1-3H3/t4?,14-/m0/s1
InChIKey ZHNXEBUBBMAMEW-GONFFSLRSA-N
Mol Weight 280.38 g/mol
Molecular Formula C15H20O3S
Exact Mass 280.113316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6wbshcM3YVG
Name 1,2-Heptadien-4-ol, 6-methyl-1-[(4-methylphenyl)sulfonyl]-, (R*,S*)-(.+-.)-
Alternate Name(s) (4R)-6-methyl-1-[(4-methylphenyl)sulfonyl]-1,2-heptadien-4-ol
CAS Registry Number 127381-40-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O3S
InChI InChI=1S/C15H20O3S/c1-12(2)11-14(16)5-4-10-19(17,18)15-8-6-13(3)7-9-15/h5-10,12,14,16H,11H2,1-3H3/t4?,14-/m0/s1
InChIKey ZHNXEBUBBMAMEW-GONFFSLRSA-N
Molecular Weight 280.382 g/mol
SMILES O[C@](CC(C)C)(C=C=CS(c1ccc(cc1)C)(=O)=O)[H]
SPLASH splash10-0a4u-3900000000-2b8fbcc8e7e959461c6c
Source of Spectrum J-55-4600-19
Wiley ID 1283775