| SpectraBase Compound ID | 1VllUsA2E1j |
|---|---|
| InChI | InChI=1S/C32H31ClN2O3/c33-27-18-16-25(17-19-27)29(36)32(31(38)34-28-14-8-3-9-15-28)21-26(20-23-10-4-1-5-11-23)30(37)35(32)22-24-12-6-2-7-13-24/h1-2,4-7,10-13,16-20,28H,3,8-9,14-15,21-22H2,(H,34,38)/b26-20+ |
| InChIKey | UQSIIDQNBJFUCV-LHLOQNFPSA-N |
| Mol Weight | 527.1 g/mol |
| Molecular Formula | C32H31ClN2O3 |
| Exact Mass | 526.202321 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AnPYbBM618r |
|---|---|
| Name | (E)-1-Benzyl-4-benzylidene-2-(4-chlorobenzoyl)-N-cyclohexyl-5-oxopyrrolidine-2-carboxamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C32H31ClN2O3 |
| InChI | InChI=1S/C32H31ClN2O3/c33-27-18-16-25(17-19-27)29(36)32(31(38)34-28-14-8-3-9-15-28)21-26(20-23-10-4-1-5-11-23)30(37)35(32)22-24-12-6-2-7-13-24/h1-2,4-7,10-13,16-20,28H,3,8-9,14-15,21-22H2,(H,34,38)/b26-20+ |
| InChIKey | UQSIIDQNBJFUCV-LHLOQNFPSA-N |
| Molecular Weight | 527.064 g/mol |
| SMILES | N(C(C1(N(C(=O)\C(C1)=C\c1ccccc1)Cc1ccccc1)C(c1ccc(cc1)Cl)=O)=O)C1CCCCC1 |
| SPLASH | splash10-0006-9023100000-3b7db0197859761a3d33 |
| Source of Spectrum | F-69-3827-6n |
| Wiley ID | 1738231 |