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Methyl 2-benzoyl-4-phenylsulphinyloxypent-2-enoate
SpectraBase Compound ID 1UWu1maWdcd
InChI InChI=1S/C19H18O5S/c1-14(24-25(22)16-11-7-4-8-12-16)13-17(19(21)23-2)18(20)15-9-5-3-6-10-15/h3-14H,1-2H3/b17-13-
InChIKey CNJKWLYSOIPVPY-LGMDPLHJSA-N
Mol Weight 358.41 g/mol
Molecular Formula C19H18O5S
Exact Mass 358.087495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KDqmKjX1ADG
Name Methyl 2-benzoyl-4-phenylsulphinyloxypent-2-enoate
Alternate Name(s) Methyl (2Z)-2-benzoyl-4-[(phenylsulfinyl)oxy]-2-pentenoate
CAS Registry Number 99683-20-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18O5S
InChI InChI=1S/C19H18O5S/c1-14(24-25(22)16-11-7-4-8-12-16)13-17(19(21)23-2)18(20)15-9-5-3-6-10-15/h3-14H,1-2H3/b17-13-
InChIKey CNJKWLYSOIPVPY-LGMDPLHJSA-N
Molecular Weight 358.408 g/mol
SMILES C(\C(C(=O)OC)=C\C(OS(=O)c1ccccc1)C)(=O)c1ccccc1
SPLASH splash10-0ar0-3950000000-17b2d64e384e2cbe3149
Source of Spectrum KC-1986-1955-31
Wiley ID 1346954