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(E)-1-Chloro-4-(4-methoxyphenyl)-1-(phenylsulfinyl)but-3-en-2-one
SpectraBase Compound ID 9wwnfsUswuF
InChI InChI=1S/C17H15ClO3S/c1-21-14-10-7-13(8-11-14)9-12-16(19)17(18)22(20)15-5-3-2-4-6-15/h2-12,17H,1H3/b12-9+
InChIKey ABQQYFMINJWYPJ-FMIVXFBMSA-N
Mol Weight 334.82 g/mol
Molecular Formula C17H15ClO3S
Exact Mass 334.043043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ck9gWxuPzBS
Name (E)-1-Chloro-4-(4-methoxyphenyl)-1-(phenylsulfinyl)but-3-en-2-one
Alternate Name(s) (3E)-1-chloro-4-(4-methoxyphenyl)-1-(phenylsulfinyl)-3-buten-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15ClO3S
InChI InChI=1S/C17H15ClO3S/c1-21-14-10-7-13(8-11-14)9-12-16(19)17(18)22(20)15-5-3-2-4-6-15/h2-12,17H,1H3/b12-9+
InChIKey ABQQYFMINJWYPJ-FMIVXFBMSA-N
Molecular Weight 334.817 g/mol
SMILES C(C(\C=C\c1ccc(cc1)OC)=O)(S(=O)c1ccccc1)Cl
SPLASH splash10-03di-0900000000-025a38522c2ff53905a1
Source of Spectrum F-57-9694-6
Wiley ID 1626498