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(E)-1-(benzenesulfinyl)-1-chloro-4-phenyl-3-buten-2-one
SpectraBase Compound ID L5m4HmhaiYS
InChI InChI=1S/C16H13ClO2S/c17-16(20(19)14-9-5-2-6-10-14)15(18)12-11-13-7-3-1-4-8-13/h1-12,16H/b12-11+
InChIKey NDSZYAWNXHKWKE-VAWYXSNFSA-N
Mol Weight 304.79 g/mol
Molecular Formula C16H13ClO2S
Exact Mass 304.032479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 80J3GnEMQv7
Name (E)-1-(benzenesulfinyl)-1-chloro-4-phenyl-3-buten-2-one
Alternate Name(s) (E)-1-(benzenesulfinyl)-1-chloro-4-phenyl-but-3-en-2-one (E)-1-chloranyl-4-phenyl-1-(phenylsulfinyl)but-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13ClO2S
InChI InChI=1S/C16H13ClO2S/c17-16(20(19)14-9-5-2-6-10-14)15(18)12-11-13-7-3-1-4-8-13/h1-12,16H/b12-11+
InChIKey NDSZYAWNXHKWKE-VAWYXSNFSA-N
Molecular Weight 304.791 g/mol
SMILES C(C(\C=C\c1ccccc1)=O)(S(=O)c1ccccc1)Cl
SPLASH splash10-00lr-0900000000-0b9413b4618b1ae2b6af
Source of Spectrum F-57-9693-6
Wiley ID 1626508