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Benzenemethanol, .alpha.-[3-[(4-methylphenyl)sulfinyl]-2-propenyl]-, [R-[R*,R*-(E)]]-
SpectraBase Compound ID HcH30fxg6Y7
InChI InChI=1S/C17H18O2S/c1-14-9-11-16(12-10-14)20(19)13-5-8-17(18)15-6-3-2-4-7-15/h2-7,9-13,17-18H,8H2,1H3/b13-5+
InChIKey OUPXJUOJIUNYKS-WLRTZDKTSA-N
Mol Weight 286.39 g/mol
Molecular Formula C17H18O2S
Exact Mass 286.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4A5k6uRJDsK
Name Benzenemethanol, .alpha.-[3-[(4-methylphenyl)sulfinyl]-2-propenyl]-, [R-[R*,R*-(E)]]-
CAS Registry Number 78012-59-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O2S
InChI InChI=1S/C17H18O2S/c1-14-9-11-16(12-10-14)20(19)13-5-8-17(18)15-6-3-2-4-7-15/h2-7,9-13,17-18H,8H2,1H3/b13-5+
InChIKey OUPXJUOJIUNYKS-WLRTZDKTSA-N
Molecular Weight 286.389 g/mol
SMILES OC(c1ccccc1)C\C=C\S(c1ccc(cc1)C)=O
SPLASH splash10-0bwc-4900000000-3852ce27c98ca3ec5abf
Source of Spectrum B-33-2650-0
Synonyms Benzenemethanol, .alpha.-[3-[(4-methylphenyl)sulfinyl]-2-propenyl]-, [R*,R*-(E)]-(.+-.)- (3E)-4-[(4-methylphenyl)sulfinyl]-1-phenyl-3-buten-1-ol (E)-1-Phenyl-4-(p-methylphenylsulfinyl)but-3-en-1-ol
Wiley ID 1289953