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4,5-Imidazolidinedicarboxylic acid, 2-oxo-1,3-bis(phenylmethyl)-
SpectraBase Compound ID 5WY2BnsdJal
InChI InChI=1S/C19H18N2O5/c22-17(23)15-16(18(24)25)21(12-14-9-5-2-6-10-14)19(26)20(15)11-13-7-3-1-4-8-13/h1-10,15-16H,11-12H2,(H,22,23)(H,24,25)
InChIKey QSMUFXXTSUEZJA-UHFFFAOYSA-N
Mol Weight 354.36 g/mol
Molecular Formula C19H18N2O5
Exact Mass 354.121572 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4xSwpJL85N4
Name 4,5-Imidazolidinedicarboxylic acid, 2-oxo-1,3-bis(phenylmethyl)-
Comments Computed using HOSE algorithm
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Exact Mass 354.121571683 u
Formula C19H18N2O5
InChI InChI=1S/C19H18N2O5/c22-17(23)15-16(18(24)25)21(12-14-9-5-2-6-10-14)19(26)20(15)11-13-7-3-1-4-8-13/h1-10,15-16H,11-12H2,(H,22,23)(H,24,25)
InChIKey QSMUFXXTSUEZJA-UHFFFAOYSA-N
Molecular Weight 354.362 g/mol
SMILES OC(C1N(C(N(C1C(=O)O)CC=1C=CC=CC1)=O)CC1=CC=CC=C1)=O