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4-Phenylsulfoxo-5-phenyl-4-pentanoic acid ethyl ester
SpectraBase Compound ID GCYRK6mB6SH
InChI InChI=1S/C19H20O3S/c1-2-22-19(20)14-13-18(15-16-9-5-3-6-10-16)23(21)17-11-7-4-8-12-17/h3-12,15H,2,13-14H2,1H3/b18-15+
InChIKey RJFIXZWNOSMTRU-OBGWFSINSA-N
Mol Weight 328.43 g/mol
Molecular Formula C19H20O3S
Exact Mass 328.113316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9HjxcrzXhEz
Name 4-Phenylsulfoxo-5-phenyl-4-pentanoic acid ethyl ester
Alternate Name(s) Ethyl (4E)-5-phenyl-4-(phenylsulfinyl)-4-pentenoate
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Formula C19H20O3S
InChI InChI=1S/C19H20O3S/c1-2-22-19(20)14-13-18(15-16-9-5-3-6-10-16)23(21)17-11-7-4-8-12-17/h3-12,15H,2,13-14H2,1H3/b18-15+
InChIKey RJFIXZWNOSMTRU-OBGWFSINSA-N
Molecular Weight 328.426 g/mol
SMILES c1(S(\C(=C\c2ccccc2)CCC(=O)OCC)=O)ccccc1
SPLASH splash10-01vk-6930000000-bcca3a4bdbb681a33b98
Source of Spectrum AJ-61-3963-11
Wiley ID 1326322