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Benzenemethanol, .alpha.-[1-(phenylthio)-2-propenyl]-
SpectraBase Compound ID LUQ6eh03lc8
InChI InChI=1S/C16H16OS/c1-2-15(18-14-11-7-4-8-12-14)16(17)13-9-5-3-6-10-13/h2-12,15-17H,1H2
InChIKey MSOGLUHWPJRYSJ-UHFFFAOYSA-N
Mol Weight 256.36 g/mol
Molecular Formula C16H16OS
Exact Mass 256.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HxTvVJZGZXJ
Name Benzenemethanol, .alpha.-[1-(phenylthio)-2-propenyl]-
CAS Registry Number 76126-88-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16OS
InChI InChI=1S/C16H16OS/c1-2-15(18-14-11-7-4-8-12-14)16(17)13-9-5-3-6-10-13/h2-12,15-17H,1H2
InChIKey MSOGLUHWPJRYSJ-UHFFFAOYSA-N
Molecular Weight 256.363 g/mol
SMILES OC(C(Sc1ccccc1)C=C)c1ccccc1
SPLASH splash10-0udi-2900000000-3bc0ca034f8ae7b9a1cb
Source of Spectrum B-33-1351-0
Synonyms 1-Phenyl-2-(phenylsulfanyl)-3-buten-1-ol 1-Phenyl-2-(phenylthio)but-3-en-1-ol
Wiley ID 1259992