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2-(4-Chlorophenyl)-5-morpholin-4-yl-3H-imidazol-4-carboxylic acid, ethyl ester
SpectraBase Compound ID 5AcOyE3xK1g
InChI InChI=1S/C16H18ClN3O3/c1-2-23-16(21)13-15(20-7-9-22-10-8-20)19-14(18-13)11-3-5-12(17)6-4-11/h3-6H,2,7-10H2,1H3,(H,18,19)
InChIKey OPZNFHDMUUXXBC-UHFFFAOYSA-N
Mol Weight 335.79 g/mol
Molecular Formula C16H18ClN3O3
Exact Mass 335.103669 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7mwVraS5SM3
Name 2-(4-Chlorophenyl)-5-morpholin-4-yl-3H-imidazol-4-carboxylic acid, ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 335.103669149 u
Formula C16H18ClN3O3
InChI InChI=1S/C16H18ClN3O3/c1-2-23-16(21)13-15(20-7-9-22-10-8-20)19-14(18-13)11-3-5-12(17)6-4-11/h3-6H,2,7-10H2,1H3,(H,18,19)
InChIKey OPZNFHDMUUXXBC-UHFFFAOYSA-N
Molecular Weight 335.791 g/mol
SMILES C1(=CC=C(C=C1)C=1NC(C(=O)OCC)=C(N1)N1CCOCC1)Cl