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Methyl 2-benzoyl-4-phenylthiopent-2-enoate
SpectraBase Compound ID K7ESjvs8v8W
InChI InChI=1S/C19H18O3S/c1-14(23-16-11-7-4-8-12-16)13-17(19(21)22-2)18(20)15-9-5-3-6-10-15/h3-14H,1-2H3/b17-13-
InChIKey JGDGGNUPHZWYHZ-LGMDPLHJSA-N
Mol Weight 326.41 g/mol
Molecular Formula C19H18O3S
Exact Mass 326.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5J8nuo7Iaoz
Name Methyl 2-benzoyl-4-phenylthiopent-2-enoate
CAS Registry Number 99683-15-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18O3S
InChI InChI=1S/C19H18O3S/c1-14(23-16-11-7-4-8-12-16)13-17(19(21)22-2)18(20)15-9-5-3-6-10-15/h3-14H,1-2H3/b17-13-
InChIKey JGDGGNUPHZWYHZ-LGMDPLHJSA-N
Molecular Weight 326.410 g/mol
SMILES C(\C(C(=O)OC)=C\C(Sc1ccccc1)C)(=O)c1ccccc1
SPLASH splash10-0a70-1900000000-a3c43e11b0161e9f1255
Source of Spectrum KC-1986-1955-21
Synonyms Methyl (2Z)-2-benzoyl-4-(phenylsulfanyl)-2-pentenoate
Wiley ID 1324828