| SpectraBase Compound ID | I3nmYFGqP1T |
|---|---|
| InChI | InChI=1S/C9H18N2O3/c1-5(2)4-7(10)8(12)11-6(3)9(13)14/h5-7H,4,10H2,1-3H3,(H,11,12)(H,13,14)/t6-,7-/m0/s1 |
| InChIKey | HSQGMTRYSIHDAC-BQBZGAKWSA-N |
| Mol Weight | 202.25 g/mol |
| Molecular Formula | C9H18N2O3 |
| Exact Mass | 202.131742 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GIawHLr25Av |
|---|---|
| Name | L-Leucyl-L-alanine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 202.131742445 u |
| Formula | C9H18N2O3 |
| InChI | InChI=1S/C9H18N2O3/c1-5(2)4-7(10)8(12)11-6(3)9(13)14/h5-7H,4,10H2,1-3H3,(H,11,12)(H,13,14)/t6-,7-/m0/s1 |
| InChIKey | HSQGMTRYSIHDAC-BQBZGAKWSA-N |
| Molecular Weight | 202.254 g/mol |
| Nominal Mass | 202 u |
| SMILES | CC(C)C[C@](N)(C(=O)N[C@@](C)(C(=O)O)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.921884 |