| SpectraBase Compound ID | 7WeUoZoJ1Oi |
|---|---|
| InChI | InChI=1S/C15H24N2O5/c1-4-17-11-7-8-15(13(19)21-5-2,14(20)22-6-3)9-10(11)12(16)18/h4,10-11H,5-9H2,1-3H3,(H2,16,18)/b17-4+/t10-,11+/m0/s1 InChI=1S/C15H24N2O5/c1-4-17-11-7-8-15(13(19)21-5-2,14(20)22-6-3)9-10(11)12(16)18/h4,10-11H,5-9H2,1-3H3,(H2,16,18)/b17-4+/t10-,11+/m1/s1 |
| InChIKey | INXDHBZLYALAEA-PCAKJNRKSA-N |
| Mol Weight | 312.37 g/mol |
| Molecular Formula | C15H24N2O5 |
| Exact Mass | 312.168522 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | xxd30J89Z0 |
|---|---|
| Name | cis-3-Carbamoyl-4-(ethylideneamino)-1,1-cyclohexanedicarboxylic acid, diethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.168521876 u |
| Formula | C15H24N2O5 |
| InChI | InChI=1S/C15H24N2O5/c1-4-17-11-7-8-15(13(19)21-5-2,14(20)22-6-3)9-10(11)12(16)18/h4,10-11H,5-9H2,1-3H3,(H2,16,18)/b17-4+/t10-,11+/m0/s1 |
| InChIKey | INXDHBZLYALAEA-PCAKJNRKSA-N |
| SMILES | NC([C@]1(CC(CC[C@]1(\N=C\C)[H])(C(=O)OCC)C(OCC)=O)[H])=O |
| Spectrum/Structure Validation Score (Raman) | 0.850941 |