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5-Benzylamino-2-(4-methoxyphenyl)-3H-imidazol-4-carboxylic acid, methyl ester
SpectraBase Compound ID HQXBzYopTtQ
InChI InChI=1S/C19H19N3O3/c1-24-15-10-8-14(9-11-15)17-21-16(19(23)25-2)18(22-17)20-12-13-6-4-3-5-7-13/h3-11,20H,12H2,1-2H3,(H,21,22)
InChIKey RRCUFITYMYKDHU-UHFFFAOYSA-N
Mol Weight 337.38 g/mol
Molecular Formula C19H19N3O3
Exact Mass 337.142641 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JDrUfseLmvY
Name 5-Benzylamino-2-(4-methoxyphenyl)-3H-imidazol-4-carboxylic acid, methyl ester
Comments Computed using HOSE algorithm
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Exact Mass 337.142641481 u
Formula C19H19N3O3
InChI InChI=1S/C19H19N3O3/c1-24-15-10-8-14(9-11-15)17-21-16(19(23)25-2)18(22-17)20-12-13-6-4-3-5-7-13/h3-11,20H,12H2,1-2H3,(H,21,22)
InChIKey RRCUFITYMYKDHU-UHFFFAOYSA-N
Molecular Weight 337.379 g/mol
SMILES C1(=CC=C(C=C1)OC)C=1NC(=C(NCC2=CC=CC=C2)N1)C(=O)OC