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Benzenemethanol, .alpha.-[3-[(4-methylphenyl)thio]-2-propenyl]-, (E)-
SpectraBase Compound ID IVWIMgm1bY7
InChI InChI=1S/C17H18OS/c1-14-9-11-16(12-10-14)19-13-5-8-17(18)15-6-3-2-4-7-15/h2-7,9-13,17-18H,8H2,1H3/b13-5+
InChIKey NLRDUAZTFUHLSK-WLRTZDKTSA-N
Mol Weight 270.39 g/mol
Molecular Formula C17H18OS
Exact Mass 270.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AjyKga30ZbB
Name Benzenemethanol, .alpha.-[3-[(4-methylphenyl)thio]-2-propenyl]-, (E)-
CAS Registry Number 76120-47-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18OS
InChI InChI=1S/C17H18OS/c1-14-9-11-16(12-10-14)19-13-5-8-17(18)15-6-3-2-4-7-15/h2-7,9-13,17-18H,8H2,1H3/b13-5+
InChIKey NLRDUAZTFUHLSK-WLRTZDKTSA-N
Molecular Weight 270.390 g/mol
SMILES OC(c1ccccc1)C\C=C\Sc1ccc(cc1)C
SPLASH splash10-03di-1900000000-fe76a1085d0024924359
Source of Spectrum B-33-1352-0
Synonyms (3E)-4-[(4-methylphenyl)sulfanyl]-1-phenyl-3-buten-1-ol (E)-4-(p-methylphenylthio)-1-phenylbut-3-en-1-ol
Wiley ID 1274529