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N-(2-methyl-4-nitro-phenyl)-2,2-diphenyl-acetamide
SpectraBase Compound ID GfqIlFgaZ5B
InChI InChI=1S/C21H18N2O3/c1-15-14-18(23(25)26)12-13-19(15)22-21(24)20(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-14,20H,1H3,(H,22,24)
InChIKey QZGDKFQMFMANKP-UHFFFAOYSA-N
Mol Weight 346.39 g/mol
Molecular Formula C21H18N2O3
Exact Mass 346.131742 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8T7c4al0nKT
Name N-(2-Methyl-4-nitro-phenyl)-2,2-diphenyl-acetamide
Comments Computed using HOSE algorithm
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Exact Mass 346.131742445 u
Formula C21H18N2O3
InChI InChI=1S/C21H18N2O3/c1-15-14-18(23(25)26)12-13-19(15)22-21(24)20(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-14,20H,1H3,(H,22,24)
InChIKey QZGDKFQMFMANKP-UHFFFAOYSA-N
Molecular Weight 346.386 g/mol
SMILES C=1C=CC(C(C(NC=2C=CC(N(=O)=O)=CC2C)=O)C2=CC=CC=C2)=CC1