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5-Morpholin-4-yl-2-(4-nitrophenyl)-3H-imidazol-4-carboxylic acid, methyl ester

View entire compound with spectra: 1 NMR

5-Morpholin-4-yl-2-(4-nitrophenyl)-3H-imidazol-4-carboxylic acid, methyl ester
SpectraBase Compound ID GtrRFkXa5zM
InChI InChI=1S/C15H16N4O5/c1-23-15(20)12-14(18-6-8-24-9-7-18)17-13(16-12)10-2-4-11(5-3-10)19(21)22/h2-5H,6-9H2,1H3,(H,16,17)
InChIKey PSUXWAPRMFUIIU-UHFFFAOYSA-N
Mol Weight 332.32 g/mol
Molecular Formula C15H16N4O5
Exact Mass 332.11207 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3iSTarhVASD
Name 5-Morpholin-4-yl-2-(4-nitrophenyl)-3H-imidazol-4-carboxylic acid, methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 332.112069626 u
Formula C15H16N4O5
InChI InChI=1S/C15H16N4O5/c1-23-15(20)12-14(18-6-8-24-9-7-18)17-13(16-12)10-2-4-11(5-3-10)19(21)22/h2-5H,6-9H2,1H3,(H,16,17)
InChIKey PSUXWAPRMFUIIU-UHFFFAOYSA-N
Molecular Weight 332.316 g/mol
SMILES C=1(NC(C(OC)=O)=C(N1)N1CCOCC1)C1=CC=C(C=C1)N(=O)=O