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(Z)-4-keto-2,3-diphenyl-oct-2-enoic acid methyl ester
SpectraBase Compound ID LLGnL4nVHox
InChI InChI=1S/C21H22O3/c1-3-4-15-18(22)19(16-11-7-5-8-12-16)20(21(23)24-2)17-13-9-6-10-14-17/h5-14H,3-4,15H2,1-2H3/b20-19-
InChIKey PCMNLTZSRDIRDK-VXPUYCOJSA-N
Mol Weight 322.4 g/mol
Molecular Formula C21H22O3
Exact Mass 322.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JLRi790607S
Name (Z)-4-keto-2,3-diphenyl-oct-2-enoic acid methyl ester
Alternate Name(s) (Z)-4-oxo-2,3-diphenyl-2-octenoic acid methyl ester Methyl (Z)-4-oxidanylidene-2,3-diphenyl-oct-2-enoate Methyl (Z)-4-oxo-2,3-diphenyl-oct-2-enoate
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Formula C21H22O3
InChI InChI=1S/C21H22O3/c1-3-4-15-18(22)19(16-11-7-5-8-12-16)20(21(23)24-2)17-13-9-6-10-14-17/h5-14H,3-4,15H2,1-2H3/b20-19-
InChIKey PCMNLTZSRDIRDK-VXPUYCOJSA-N
Molecular Weight 322.404 g/mol
SMILES C(\C(=C/(C(=O)OC)c1ccccc1)c1ccccc1)(=O)CCCC
SPLASH splash10-014r-3390000000-6d235f9b2dab9903b5d1
Source of Spectrum C-115-1371-14
Wiley ID 1322081