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3-Pyrrolidinecarboxylic-13C acid, 3-methyl-4,5-dioxo-1,2-diphenyl-, ethyl ester, trans-
SpectraBase Compound ID 6JRcOLghaKa
InChI InChI=1S/C20H19NO4/c1-3-25-19(24)20(2)16(14-10-6-4-7-11-14)21(18(23)17(20)22)15-12-8-5-9-13-15/h4-13,16H,3H2,1-2H3/t16-,20-/m1/s1/i19+1
InChIKey MMXQYAFKZXRKPF-BUJKVLAISA-N
Mol Weight 338.37 g/mol
Molecular Formula C1913CH19NO4
Exact Mass 338.134763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3zBu8qZpk8v
Name 3-Pyrrolidinecarboxylic-13C acid, 3-methyl-4,5-dioxo-1,2-diphenyl-, ethyl ester, trans-
CAS Registry Number 132546-98-6
Comments Original formula: C19[13C]H19NO4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19NO4
InChI InChI=1S/C20H19NO4/c1-3-25-19(24)20(2)16(14-10-6-4-7-11-14)21(18(23)17(20)22)15-12-8-5-9-13-15/h4-13,16H,3H2,1-2H3/t16-,20-/m1/s1/i19+1
InChIKey MMXQYAFKZXRKPF-BUJKVLAISA-N
Molecular Weight 338.367 g/mol
SMILES [C@]1(C(C(=O)N([C@@]1(c1ccccc1)[H])c1ccccc1)=O)([13C](=O)OCC)C
SPLASH splash10-02t9-3970000000-9eb7d684396e8aa34837
Source of Spectrum Y-27-1860-5
Synonyms Ethyl 3-methyl-4,5-dioxo-1,2-diphenyl-3-pyrrolidine[C-(13)]carboxylate
Wiley ID 1333173