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2-[2-(3,4-dimethoxyphenyl)-2-keto-ethyl]benzoic acid
SpectraBase Compound ID AsXBkfdBdvA
InChI InChI=1S/C17H16O5/c1-21-15-8-7-12(10-16(15)22-2)14(18)9-11-5-3-4-6-13(11)17(19)20/h3-8,10H,9H2,1-2H3,(H,19,20)
InChIKey BIVIPLJTXAOXML-UHFFFAOYSA-N
Mol Weight 300.31 g/mol
Molecular Formula C17H16O5
Exact Mass 300.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ZLg1Da4UGf
Name 2-(3',4'-Dimethoxybenzoylmethyl)benzoic acid
Alternate Name(s) 2-(2-(3,4-dimethoxyphenyl)-2-oxoethyl)benzoic acid
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Formula C17H16O5
InChI InChI=1S/C17H16O5/c1-21-15-8-7-12(10-16(15)22-2)14(18)9-11-5-3-4-6-13(11)17(19)20/h3-8,10H,9H2,1-2H3,(H,19,20)
InChIKey BIVIPLJTXAOXML-UHFFFAOYSA-N
Molecular Weight 300.310 g/mol
SMILES OC(=O)c1ccccc1CC(c1ccc(OC)c(OC)c1)=O
SPLASH splash10-004i-0951000000-ec5e5b63700329c5d758
Source of Spectrum QA-50-315-3
Wiley ID 1795766