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Benzenemethanol, .alpha.-[1-[(4-methoxyphenyl)sulfinyl]-2-propenyl]-, [.alpha.R*[R*(S*)]]-(.+-.)-
SpectraBase Compound ID IQQkDYObSYJ
InChI InChI=1S/C17H18O3S/c1-3-16(17(18)13-7-5-4-6-8-13)21(19)15-11-9-14(20-2)10-12-15/h3-12,16-18H,1H2,2H3
InChIKey VWHJAICFEDOPTQ-UHFFFAOYSA-N
Mol Weight 302.39 g/mol
Molecular Formula C17H18O3S
Exact Mass 302.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID R6klz4DWZY
Name Benzenemethanol, .alpha.-[1-[(4-methoxyphenyl)sulfinyl]-2-propenyl]-, [.alpha.R*[R*(S*)]]-(.+-.)-
Alternate Name(s) 1-Phenyl-2-(p-methoxyphenylsulfinyl)but-3-en-1-ol 2-[(4-methoxyphenyl)sulfinyl]-1-phenyl-3-buten-1-ol
CAS Registry Number 78086-48-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O3S
InChI InChI=1S/C17H18O3S/c1-3-16(17(18)13-7-5-4-6-8-13)21(19)15-11-9-14(20-2)10-12-15/h3-12,16-18H,1H2,2H3
InChIKey VWHJAICFEDOPTQ-UHFFFAOYSA-N
Molecular Weight 302.388 g/mol
SMILES OC(C(S(c1ccc(cc1)OC)=O)C=C)c1ccccc1
SPLASH splash10-0a4i-0900000000-7dad1a2d23d2d22c13c7
Source of Spectrum B-33-2646-0
Wiley ID 1304616