For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1-o-Benzyl 5-o-ethyl 2-(benzylamino)imidazole-1,5-dicarboxylate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-o-Benzyl 5-o-ethyl 2-(benzylamino)imidazole-1,5-dicarboxylate
SpectraBase Compound ID Gg8M0cTRC7a
InChI InChI=1S/C21H21N3O4/c1-2-27-19(25)18-14-23-20(22-13-16-9-5-3-6-10-16)24(18)21(26)28-15-17-11-7-4-8-12-17/h3-12,14H,2,13,15H2,1H3,(H,22,23)
InChIKey FULBDEBAELPSHO-UHFFFAOYSA-N
Mol Weight 379.42 g/mol
Molecular Formula C21H21N3O4
Exact Mass 379.153206 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID A7XzGLtNHiV
Name 1-o-Benzyl 5-o-ethyl 2-(benzylamino)imidazole-1,5-dicarboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 379.153206164 u
Formula C21H21N3O4
InChI InChI=1S/C21H21N3O4/c1-2-27-19(25)18-14-23-20(22-13-16-9-5-3-6-10-16)24(18)21(26)28-15-17-11-7-4-8-12-17/h3-12,14H,2,13,15H2,1H3,(H,22,23)
InChIKey FULBDEBAELPSHO-UHFFFAOYSA-N
Molecular Weight 379.416 g/mol
SMILES C=1(N(C(=NC1)NCC=1C=CC=CC1)C(OCC=1C=CC=CC1)=O)C(=O)OCC