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N-[2-(aminocarbonyl)phenyl]-9H-xanthene-9-carboxamide
SpectraBase Compound ID 5VbbaWbc80V
InChI InChI=1S/C21H16N2O3/c22-20(24)13-7-1-4-10-16(13)23-21(25)19-14-8-2-5-11-17(14)26-18-12-6-3-9-15(18)19/h1-12,19H,(H2,22,24)(H,23,25)
InChIKey AHZWZHQFQZTULF-UHFFFAOYSA-N
Mol Weight 344.37 g/mol
Molecular Formula C21H16N2O3
Exact Mass 344.116092 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7hsLxSZMNrX
Name N-[2-(Aminocarbonyl)phenyl]-9H-xanthene-9-carboxamide
Comments Computed using HOSE algorithm
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Exact Mass 344.116092380 u
Formula C21H16N2O3
InChI InChI=1S/C21H16N2O3/c22-20(24)13-7-1-4-10-16(13)23-21(25)19-14-8-2-5-11-17(14)26-18-12-6-3-9-15(18)19/h1-12,19H,(H2,22,24)(H,23,25)
InChIKey AHZWZHQFQZTULF-UHFFFAOYSA-N
Molecular Weight 344.370 g/mol
SMILES N(C(C1C2=C(C=CC=C2)OC2=C1C=CC=C2)=O)C=1C(C(=O)N)=CC=CC1