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1,4-Dihydro-2-hydroxy-12-oxo-6H-benzimidazo[2,1-B]quinazoline-3-carboxylic acid, ethyl ester
SpectraBase Compound ID 2ZxZVRXGE0E
InChI InChI=1S/C17H15N3O4/c1-2-24-16(23)10-7-12-9(8-14(10)21)15(22)20-13-6-4-3-5-11(13)18-17(20)19-12/h3-6,21H,2,7-8H2,1H3,(H,18,19)
InChIKey DMFJOBMRPOMZNM-UHFFFAOYSA-N
Mol Weight 325.32 g/mol
Molecular Formula C17H15N3O4
Exact Mass 325.106256 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 38PVbb4Z0q4
Name 1,4-Dihydro-2-hydroxy-12-oxo-6H-benzimidazo[2,1-B]quinazoline-3-carboxylic acid, ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 325.106255971 u
Formula C17H15N3O4
InChI InChI=1S/C17H15N3O4/c1-2-24-16(23)10-7-12-9(8-14(10)21)15(22)20-13-6-4-3-5-11(13)18-17(20)19-12/h3-6,21H,2,7-8H2,1H3,(H,18,19)
InChIKey DMFJOBMRPOMZNM-UHFFFAOYSA-N
Molecular Weight 325.324 g/mol
SMILES OC=1CC=2C(=O)N3C=4C=CC=CC4NC3=NC2CC1C(=O)OCC