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(E)-1-Chloro-3-methyl-4-phenyl-1-(phenylsulfinyl)but-3-en-2-ol
SpectraBase Compound ID 60nIHOLbUIe
InChI InChI=1S/C17H17ClO2S/c1-13(12-14-8-4-2-5-9-14)16(19)17(18)21(20)15-10-6-3-7-11-15/h2-12,16-17,19H,1H3/b13-12+
InChIKey RZLIUAWCHJNRKN-OUKQBFOZSA-N
Mol Weight 320.83 g/mol
Molecular Formula C17H17ClO2S
Exact Mass 320.063779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ealFxctvSl
Name (E)-1-Chloro-3-methyl-4-phenyl-1-(phenylsulfinyl)but-3-en-2-ol
Alternate Name(s) (3E)-1-chloro-3-methyl-4-phenyl-1-(phenylsulfinyl)-3-buten-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17ClO2S
InChI InChI=1S/C17H17ClO2S/c1-13(12-14-8-4-2-5-9-14)16(19)17(18)21(20)15-10-6-3-7-11-15/h2-12,16-17,19H,1H3/b13-12+
InChIKey RZLIUAWCHJNRKN-OUKQBFOZSA-N
Molecular Weight 320.834 g/mol
SMILES OC(C(S(=O)c1ccccc1)Cl)\C(=C\c1ccccc1)C
SPLASH splash10-004i-0900000000-9ccfd7a7118741b71a39
Source of Spectrum F-57-9694-8
Wiley ID 1626501