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(E)-5-(benzenesulfinyl)-3-penten-1-ol
SpectraBase Compound ID GVSERZlhdjM
InChI InChI=1S/C11H14O2S/c12-9-5-2-6-10-14(13)11-7-3-1-4-8-11/h1-4,6-8,12H,5,9-10H2/b6-2+
InChIKey PBQIBOQAGXCGJJ-QHHAFSJGSA-N
Mol Weight 210.29 g/mol
Molecular Formula C11H14O2S
Exact Mass 210.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IRPvQHbJKIP
Name (E)-5-(benzenesulfinyl)-3-penten-1-ol
Alternate Name(s) (E)-5-(benzenesulfinyl)pent-3-en-1-ol (E)-5-(phenylsulfinyl)pent-3-en-1-ol
CAS Registry Number 114678-57-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2S
InChI InChI=1S/C11H14O2S/c12-9-5-2-6-10-14(13)11-7-3-1-4-8-11/h1-4,6-8,12H,5,9-10H2/b6-2+
InChIKey PBQIBOQAGXCGJJ-QHHAFSJGSA-N
Molecular Weight 210.291 g/mol
SMILES OCC\C=C\CS(=O)c1ccccc1
SPLASH splash10-004i-0900000000-d7676558ab1313cc0422
Source of Spectrum C-110-5417-12
Wiley ID 1208822