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

*Links on SpectraBase are not permalinks.

4,4-Imidazolidinedicarboxylic acid, 1-[2-ethoxy-1-(ethoxycarbonyl)-2-oxoethyl]-2,5-bis(4-nitrophenyl)-, diethyl ester, trans-

View entire compound with spectra: 1 MS (GC)

4,4-Imidazolidinedicarboxylic acid, 1-[2-ethoxy-1-(ethoxycarbonyl)-2-oxoethyl]-2,5-bis(4-nitrophenyl)-, diethyl ester, trans-
SpectraBase Compound ID AAfmcMuZluK
InChI InChI=1S/C28H32N4O12/c1-5-41-24(33)21(25(34)42-6-2)30-22(17-9-13-19(14-10-17)31(37)38)28(26(35)43-7-3,27(36)44-8-4)29-23(30)18-11-15-20(16-12-18)32(39)40/h9-16,21-23,29H,5-8H2,1-4H3/t22-,23-/m0/s1
InChIKey VZBYVYOABLAUNS-GOTSBHOMSA-N
Mol Weight 616.6 g/mol
Molecular Formula C28H32N4O12
Exact Mass 616.201672 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 4kfC6wcHYBe
Name 4,4-Imidazolidinedicarboxylic acid, 1-[2-ethoxy-1-(ethoxycarbonyl)-2-oxoethyl]-2,5-bis(4-nitrophenyl)-, diethyl ester, trans-
CAS Registry Number 125660-53-9
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H32N4O12
InChI InChI=1S/C28H32N4O12/c1-5-41-24(33)21(25(34)42-6-2)30-22(17-9-13-19(14-10-17)31(37)38)28(26(35)43-7-3,27(36)44-8-4)29-23(30)18-11-15-20(16-12-18)32(39)40/h9-16,21-23,29H,5-8H2,1-4H3/t22-,23-/m0/s1
InChIKey VZBYVYOABLAUNS-GOTSBHOMSA-N
Molecular Weight 616.580 g/mol
SMILES N1C([C@@](N([C@]1(c1ccc(N(=O)=O)cc1)[H])C(C(=O)OCC)C(=O)OCC)(c1ccc(N(=O)=O)cc1)[H])(C(=O)OCC)C(=O)OCC
SPLASH splash10-000i-2390000000-eccee9e7240ab7e160a8
Source of Spectrum F-45-4659-4
Synonyms 1-Di(ethoxycarbonyl)methyl-2,5-(4'-nitrophenyl)-4,4-diethoxycarbonylimidazolidine Diethyl (2S,5S)-1-[2-ethoxy-1-(ethoxycarbonyl)-2-oxoethyl]-2,5-bis(4-nitrophenyl)-4,4-imidazolidinedicarboxylate
Wiley ID 1411295