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

*Links on SpectraBase are not permalinks.

Dimethyl-(2'S,2R)-(+)-2-(4-benzyloxy-3-methoxyphenyl)-4-[2-(methoxymethyl)pyrrolidinoimino]-4-phenyl-1,1-butanedicarboxylate

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

Dimethyl-(2'S,2R)-(+)-2-(4-benzyloxy-3-methoxyphenyl)-4-[2-(methoxymethyl)pyrrolidinoimino]-4-phenyl-1,1-butanedicarboxylate
SpectraBase Compound ID LIGxulvmwub
InChI InChI=1S/C34H40N2O7/c1-39-23-27-16-11-19-36(27)35-29(25-14-9-6-10-15-25)21-28(32(33(37)41-3)34(38)42-4)26-17-18-30(31(20-26)40-2)43-22-24-12-7-5-8-13-24/h5-10,12-15,17-18,20,27-28,32H,11,16,19,21-23H2,1-4H3/b35-29+/t27-,28-/m0/s1
InChIKey CZVPCAXSVXORGO-SARBTWNNSA-N
Mol Weight 588.7 g/mol
Molecular Formula C34H40N2O7
Exact Mass 588.283552 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

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

SpectraBase Spectrum ID KtxQoK0s36w
Name Dimethyl-(2'S,2R)-(+)-2-(4-benzyloxy-3-methoxyphenyl)-4-[2-(methoxymethyl)pyrrolidinoimino]-4-phenyl-1,1-butanedicarboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 588.283551629 u
Formula C34H40N2O7
InChI InChI=1S/C34H40N2O7/c1-39-23-27-16-11-19-36(27)35-29(25-14-9-6-10-15-25)21-28(32(33(37)41-3)34(38)42-4)26-17-18-30(31(20-26)40-2)43-22-24-12-7-5-8-13-24/h5-10,12-15,17-18,20,27-28,32H,11,16,19,21-23H2,1-4H3/b35-29+/t27-,28-/m0/s1
InChIKey CZVPCAXSVXORGO-SARBTWNNSA-N
Molecular Weight 588.701 g/mol
SMILES C([C@@](C\C(=N/N1[C@](COC)(CCC1)[H])C=1C=CC=CC1)(C=1C=C(OC)C(=CC1)OCC=1C=CC=CC1)[H])(C(=O)OC)C(=O)OC