For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzenemethanol, .alpha.-[2-methyl-3-(phenylsulfinyl)-2-propenyl]-, [R*,S*-(E)]-(.+-.)-
SpectraBase Compound ID E2xp0k1wzrb
InChI InChI=1S/C17H18O2S/c1-14(12-17(18)15-8-4-2-5-9-15)13-20(19)16-10-6-3-7-11-16/h2-11,13,17-18H,12H2,1H3/b14-13+
InChIKey XEQKEIUILCQKNO-BUHFOSPRSA-N
Mol Weight 286.39 g/mol
Molecular Formula C17H18O2S
Exact Mass 286.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9YM52NKaUDT
Name Benzenemethanol, .alpha.-[2-methyl-3-(phenylsulfinyl)-2-propenyl]-, [R*,S*-(E)]-(.+-.)-
CAS Registry Number 78012-64-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O2S
InChI InChI=1S/C17H18O2S/c1-14(12-17(18)15-8-4-2-5-9-15)13-20(19)16-10-6-3-7-11-16/h2-11,13,17-18H,12H2,1H3/b14-13+
InChIKey XEQKEIUILCQKNO-BUHFOSPRSA-N
Molecular Weight 286.389 g/mol
SMILES OC(C\C(=C\S(=O)c1ccccc1)C)c1ccccc1
SPLASH splash10-06w9-4900000000-db7f33ea9b7007db4dd9
Source of Spectrum B-33-2649-0
Synonyms (3E)-3-methyl-1-phenyl-4-(phenylsulfinyl)-3-buten-1-ol (E)-4-(phenylsulfinyl)-3-methyl-1-phenylbut-3-en-1-ol
Wiley ID 1289950