![L-N-[(2,4-Dichlorophenoxy)acetyl]leucine](/api/spectrum/9E5KHHaTJLx/structure.png?h=300&w=458 "L-N-[(2,4-Dichlorophenoxy)acetyl]leucine")
| SpectraBase Compound ID | 4YGvE33k1cy |
|---|---|
| InChI | InChI=1S/C14H17Cl2NO4/c1-8(2)5-11(14(19)20)17-13(18)7-21-12-4-3-9(15)6-10(12)16/h3-4,6,8,11H,5,7H2,1-2H3,(H,17,18)(H,19,20) |
| InChIKey | ZPMLYWHLVRJLLM-UHFFFAOYSA-N |
| Mol Weight | 334.2 g/mol |
| Molecular Formula | C14H17Cl2NO4 |
| Exact Mass | 333.053463 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 9E5KHHaTJLx |
|---|---|
| Name | L-N-[(2,4-Dichlorophenoxy)acetyl]leucine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 333.053463427 u |
| Formula | C14H17Cl2NO4 |
| InChI | InChI=1S/C14H17Cl2NO4/c1-8(2)5-11(14(19)20)17-13(18)7-21-12-4-3-9(15)6-10(12)16/h3-4,6,8,11H,5,7H2,1-2H3,(H,17,18)(H,19,20) |
| InChIKey | ZPMLYWHLVRJLLM-UHFFFAOYSA-N |
| Molecular Weight | 334.199 g/mol |
| SMILES | N(C(COC1=C(C=C(C=C1)Cl)Cl)=O)C(C(=O)O)CC(C)C |
| Spectrum/Structure Validation Score (Raman) | 0.858653 |