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Benzenemethanol, 4-methoxy-.alpha.-[1-[(4-methylphenyl)sulfinyl]-2-propenyl]-, [.alpha.R*[S*(R*)]]-
SpectraBase Compound ID KexaMtuHZry
InChI InChI=1S/C18H20O3S/c1-14-5-11-17(12-6-14)22(20)13-3-4-18(19)15-7-9-16(21-2)10-8-15/h3,5-13,18-19H,4H2,1-2H3/b13-3+
InChIKey YWOLFJOBHIZXOD-QLKAYGNNSA-N
Mol Weight 316.42 g/mol
Molecular Formula C18H20O3S
Exact Mass 316.113316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57BmIt5XKyB
Name Benzenemethanol, 4-methoxy-.alpha.-[1-[(4-methylphenyl)sulfinyl]-2-propenyl]-, [.alpha.R*[S*(R*)]]-
Alternate Name(s) (3E)-1-(4-methoxyphenyl)-4-[(4-methylphenyl)sulfinyl]-3-buten-1-ol (E)-1-(p-methoxyphenyl)-4-(p-methylbenzenesulfinyl)but-3-en-1-ol
CAS Registry Number 87481-37-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O3S
InChI InChI=1S/C18H20O3S/c1-14-5-11-17(12-6-14)22(20)13-3-4-18(19)15-7-9-16(21-2)10-8-15/h3,5-13,18-19H,4H2,1-2H3/b13-3+
InChIKey YWOLFJOBHIZXOD-QLKAYGNNSA-N
Molecular Weight 316.415 g/mol
SMILES OC(c1ccc(cc1)OC)C\C=C\S(c1ccc(cc1)C)=O
SPLASH splash10-01q3-5900000000-e56a54978958ab733982
Source of Spectrum B-36-1052-0
Wiley ID 1316757