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Benzenemethanol, .alpha.-[3-(phenylsulfinyl)-2-butenyl]-, [R*,R*-(E)]-(.+-.)-
SpectraBase Compound ID 2sZ5uwzMsPn
InChI InChI=1S/C17H18O2S/c1-14(20(19)16-10-6-3-7-11-16)12-13-17(18)15-8-4-2-5-9-15/h2-12,17-18H,13H2,1H3/b14-12+
InChIKey RVZHZKXHGUKAFN-WYMLVPIESA-N
Mol Weight 286.39 g/mol
Molecular Formula C17H18O2S
Exact Mass 286.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ja2sGqRdW9p
Name Benzenemethanol, .alpha.-[3-(phenylsulfinyl)-2-butenyl]-, [R*,R*-(E)]-(.+-.)-
CAS Registry Number 78012-69-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O2S
InChI InChI=1S/C17H18O2S/c1-14(20(19)16-10-6-3-7-11-16)12-13-17(18)15-8-4-2-5-9-15/h2-12,17-18H,13H2,1H3/b14-12+
InChIKey RVZHZKXHGUKAFN-WYMLVPIESA-N
Molecular Weight 286.389 g/mol
SMILES OC(C\C=C/(S(=O)c1ccccc1)C)c1ccccc1
SPLASH splash10-004i-5900000000-99b6dfca812f258ba3bb
Source of Spectrum B-33-2649-0
Synonyms (3E)-1-phenyl-4-(phenylsulfinyl)-3-penten-1-ol (E)-1-Phenyl-4-(phenylsulfinyl)pent-3-en-1-ol
Wiley ID 1289951