| SpectraBase Compound ID | JBKyVABQUA7 |
|---|---|
| InChI | InChI=1S/C11H23NO2/c1-8(2)7-14-11(13)10(9(3)4)12(5)6/h8-10H,7H2,1-6H3 |
| InChIKey | IEYBEGUDLBWUCS-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 | KSVhcNiiTJs |
|---|---|
| Name | N,N-Dimethyl-L-valine, 2-methylpropyl 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/c1-8(2)7-14-11(13)10(9(3)4)12(5)6/h8-10H,7H2,1-6H3 |
| InChIKey | IEYBEGUDLBWUCS-UHFFFAOYSA-N |
| Molecular Weight | 201.310 g/mol |
| SMILES | CC(C)C(N(C)C)C(=O)OCC(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.926413 |