| SpectraBase Compound ID | D4fO0VZjf0G |
|---|---|
| InChI | InChI=1S/C24H28N2O4/c1-3-10-18-20(22(28)25-16-11-6-4-7-12-16)19(27)15-24(2,30)21(18)23(29)26-17-13-8-5-9-14-17/h4-9,11-14,18,20-21,30H,3,10,15H2,1-2H3,(H,25,28)(H,26,29)/t18-,20-,21-,24-/m0/s1 |
| InChIKey | KFCDJKDZMHGZQP-FVLCUVFVSA-N |
| Mol Weight | 408.5 g/mol |
| Molecular Formula | C24H28N2O4 |
| Exact Mass | 408.204907 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JJa2FGRYVi8 |
|---|---|
| Name | (1S,2R,3R,4S)-6-Hydroxy-6-methyl-4-oxo-N,N'-diphenyl-2-propylcyclohexane-1,3-dicarboxamide |
| Appearance | White solid |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C24H28N2O4 |
| InChI | InChI=1S/C24H28N2O4/c1-3-10-18-20(22(28)25-16-11-6-4-7-12-16)19(27)15-24(2,30)21(18)23(29)26-17-13-8-5-9-14-17/h4-9,11-14,18,20-21,30H,3,10,15H2,1-2H3,(H,25,28)(H,26,29)/t18-,20-,21-,24-/m0/s1 |
| InChIKey | KFCDJKDZMHGZQP-FVLCUVFVSA-N |
| Instrument Name | Agilent Technology |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/bkcs.12067 |
| Molecular Weight | 408.498 g/mol |
| SMILES | O[C@@]1([C@@]([C@]([C@](C(Nc2ccccc2)=O)(C(C1)=O)[H])(CCC)[H])(C(=O)Nc1ccccc1)[H])C |
| SPLASH | splash10-0006-9530000000-b0e8c7cadbefdc7969d4 |
| Source of Spectrum | QB-41-SM35-3l |
| Wiley ID | 1858482 |