| SpectraBase Compound ID | 3JGkfvPjwj4 |
|---|---|
| InChI | InChI=1S/C11H23NO2/c1-6-9(4)12-10(7-8(2)3)11(13)14-5/h8-10,12H,6-7H2,1-5H3 |
| InChIKey | XIOWEYSMLOLZBE-UHFFFAOYSA-N |
| Mol Weight | 201.31 g/mol |
| Molecular Formula | C11H23NO2 |
| Exact Mass | 201.172879 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Fkmw7v3odMB |
|---|---|
| Name | L-Leucine, N-(2-butyl)-, methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 201.172878983 u |
| Formula | C11H23NO2 |
| InChI | InChI=1S/C11H23NO2/c1-6-9(4)12-10(7-8(2)3)11(13)14-5/h8-10,12H,6-7H2,1-5H3 |
| InChIKey | XIOWEYSMLOLZBE-UHFFFAOYSA-N |
| Molecular Weight | 201.310 g/mol |
| SMILES | COC(C(CC(C)C)NC(CC)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.9176 |