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p-[3-(1-Naphthyl)ureido]hippuric acid

View entire compound with spectra: 1 NMR, and 1 FTIR

p-[3-(1-Naphthyl)ureido]hippuric acid
SpectraBase Compound ID BED3crs1k3f
InChI InChI=1S/C20H17N3O4/c24-18(25)12-21-19(26)14-8-10-15(11-9-14)22-20(27)23-17-7-3-5-13-4-1-2-6-16(13)17/h1-11H,12H2,(H,21,26)(H,24,25)(H2,22,23,27)
InChIKey NBKLMCWGFREENV-UHFFFAOYSA-N
Mol Weight 363.37 g/mol
Molecular Formula C20H17N3O4
Exact Mass 363.121906 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4F4XBXOWZWy
Name p-[3-(1-Naphthyl)ureido]hippuric acid
Comments Computed using HOSE algorithm
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Exact Mass 363.121906035 u
Formula C20H17N3O4
InChI InChI=1S/C20H17N3O4/c24-18(25)12-21-19(26)14-8-10-15(11-9-14)22-20(27)23-17-7-3-5-13-4-1-2-6-16(13)17/h1-11H,12H2,(H,21,26)(H,24,25)(H2,22,23,27)
InChIKey NBKLMCWGFREENV-UHFFFAOYSA-N
Molecular Weight 363.373 g/mol
SMILES N(C=1C=2C=CC=CC2C=CC1)C(=O)NC1=CC=C(C(=O)NCC(=O)O)C=C1