| SpectraBase Compound ID | BErb57VIKjB |
|---|---|
| InChI | InChI=1S/C20H30N2O5/c1-13(2)10-16(18(23)21-17(19(24)25)11-14(3)4)22-20(26)27-12-15-8-6-5-7-9-15/h5-9,13-14,16-17H,10-12H2,1-4H3,(H,21,23)(H,22,26)(H,24,25)/t16-,17-/m0/s1 |
| InChIKey | XGJGWYRHLPSMLW-IRXDYDNUSA-N |
| Mol Weight | 378.47 g/mol |
| Molecular Formula | C20H30N2O5 |
| Exact Mass | 378.215472 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BiPSIt7gDFk |
|---|---|
| Name | L-(-)-N-(N-carboxy-L-leucyl)leucine, N-benzyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 378.215472069 u |
| Formula | C20H30N2O5 |
| InChI | InChI=1S/C20H30N2O5/c1-13(2)10-16(18(23)21-17(19(24)25)11-14(3)4)22-20(26)27-12-15-8-6-5-7-9-15/h5-9,13-14,16-17H,10-12H2,1-4H3,(H,21,23)(H,22,26)(H,24,25)/t16-,17-/m0/s1 |
| InChIKey | XGJGWYRHLPSMLW-IRXDYDNUSA-N |
| Molecular Weight | 378.469 g/mol |
| SMILES | N([C@](C(O)=O)(CC(C)C)[H])C([C@](CC(C)C)(NC(=O)OCC=1C=CC=CC1)[H])=O |
| Spectrum/Structure Validation Score (Raman) | 0.749196 |