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(2R)-2-phenylbutanedioic acid dimethyl ester
SpectraBase Compound ID DUdUSUjQCis
InChI InChI=1S/C12H14O4/c1-15-11(13)8-10(12(14)16-2)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3/t10-/m1/s1
InChIKey CGVIBFZHFCVINR-SNVBAGLBSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4OJemwTTYO
Name (2R)-2-phenylbutanedioic acid dimethyl ester
Alternate Name(s) (2R)-2-phenylsuccinic acid dimethyl ester Dimethyl (2R)-2-phenylbutanedioate
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Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-15-11(13)8-10(12(14)16-2)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3/t10-/m1/s1
InChIKey CGVIBFZHFCVINR-SNVBAGLBSA-N
Molecular Weight 222.240 g/mol
SMILES C([C@](CC(=O)OC)(c1ccccc1)[H])(=O)OC
SPLASH splash10-01vo-1900000000-c49ba3cf793344bcd5a7
Source of Spectrum AJ-74-958-2
Wiley ID 1576772