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Methyl 2-[2'-Oxo-3'-butenyl-(4'-phenyl)]benzoate
SpectraBase Compound ID BUByUC8kpAc
InChI InChI=1S/C18H16O3/c1-21-18(20)17-10-6-5-9-15(17)13-16(19)12-11-14-7-3-2-4-8-14/h2-12H,13H2,1H3/b12-11+
InChIKey YJNNBKAMGKBZBS-VAWYXSNFSA-N
Mol Weight 280.32 g/mol
Molecular Formula C18H16O3
Exact Mass 280.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gz4HHPeiorG
Name Methyl 2-[2'-Oxo-3'-butenyl-(4'-phenyl)]benzoate
Alternate Name(s) Methyl 2-[(3E)-2-oxo-4-phenyl-3-butenyl]benzoate
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Formula C18H16O3
InChI InChI=1S/C18H16O3/c1-21-18(20)17-10-6-5-9-15(17)13-16(19)12-11-14-7-3-2-4-8-14/h2-12H,13H2,1H3/b12-11+
InChIKey YJNNBKAMGKBZBS-VAWYXSNFSA-N
Molecular Weight 280.323 g/mol
SMILES C(c1c(CC(\C=C\c2ccccc2)=O)cccc1)(=O)OC
SPLASH splash10-0a4i-0910000000-aceea7a9e2af5ef01b89
Source of Spectrum F7-20-65-6
Wiley ID 1556941