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2-[(1R)-3-keto-1,3-diphenyl-propyl]malonic acid dimethyl ester
SpectraBase Compound ID K3ZaBH9SvBD
InChI InChI=1S/C20H20O5/c1-24-19(22)18(20(23)25-2)16(14-9-5-3-6-10-14)13-17(21)15-11-7-4-8-12-15/h3-12,16,18H,13H2,1-2H3/t16-/m0/s1
InChIKey OEVOEEJXYIQEKP-INIZCTEOSA-N
Mol Weight 340.38 g/mol
Molecular Formula C20H20O5
Exact Mass 340.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 87tOjMQViFS
Name 2-[(1R)-3-keto-1,3-diphenyl-propyl]malonic acid dimethyl ester
Alternate Name(s) 2-[(1R)-3-oxo-1,3-diphenylpropyl]propanedioic acid dimethyl ester dimethyl 2-[(1R)-3-oxidanylidene-1,3-diphenyl-propyl]propanedioate dimethyl 2-[(1R)-3-oxo-1,3-diphenyl-propyl]propanedioate
CAS Registry Number 109012-83-1
Comments Less than 3 mono-isotopic peaks
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Formula C20H20O5
InChI InChI=1S/C20H20O5/c1-24-19(22)18(20(23)25-2)16(14-9-5-3-6-10-14)13-17(21)15-11-7-4-8-12-15/h3-12,16,18H,13H2,1-2H3/t16-/m0/s1
InChIKey OEVOEEJXYIQEKP-INIZCTEOSA-N
Molecular Weight 340.375 g/mol
SMILES C([C@@](CC(=O)c1ccccc1)(c1ccccc1)[H])(C(=O)OC)C(=O)OC
SPLASH splash10-0a4i-0900000000-10c18533f5f7aca667b4
Source of Spectrum K-120-1734-0
Wiley ID 1335252