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N-Benzyl-4-(2,5-dioxopyrrol-1-yl)benzamide
SpectraBase Compound ID 9jJKXCvv2Jg
InChI InChI=1S/C18H14N2O3/c21-16-10-11-17(22)20(16)15-8-6-14(7-9-15)18(23)19-12-13-4-2-1-3-5-13/h1-11H,12H2,(H,19,23)
InChIKey UGCUCHVZTMZRHW-UHFFFAOYSA-N
Mol Weight 306.32 g/mol
Molecular Formula C18H14N2O3
Exact Mass 306.100442 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID QUP9BpyPhW
Name N-Benzyl-4-(2,5-dioxopyrrol-1-yl)benzamide
Comments Computed using HOSE algorithm
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Exact Mass 306.100442316 u
Formula C18H14N2O3
InChI InChI=1S/C18H14N2O3/c21-16-10-11-17(22)20(16)15-8-6-14(7-9-15)18(23)19-12-13-4-2-1-3-5-13/h1-11H,12H2,(H,19,23)
InChIKey UGCUCHVZTMZRHW-UHFFFAOYSA-N
Molecular Weight 306.321 g/mol
SMILES C1(C=CC(N1C1=CC=C(C=C1)C(NCC1=CC=CC=C1)=O)=O)=O