| SpectraBase Compound ID | 3AuAqrQ646p |
|---|---|
| InChI | InChI=1S/C13H23NO3/c1-9(2)8-11(13(16)17-3)14-12(15)10-6-4-5-7-10/h9-11H,4-8H2,1-3H3,(H,14,15) |
| InChIKey | BWGIUFWQIPSJNR-UHFFFAOYSA-N |
| Mol Weight | 241.33 g/mol |
| Molecular Formula | C13H23NO3 |
| Exact Mass | 241.167794 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5Q6GUIR2F7Y |
|---|---|
| Name | L-Leucine, N-cyclopentylcarbonyl-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 241.167793602 u |
| Formula | C13H23NO3 |
| InChI | InChI=1S/C13H23NO3/c1-9(2)8-11(13(16)17-3)14-12(15)10-6-4-5-7-10/h9-11H,4-8H2,1-3H3,(H,14,15) |
| InChIKey | BWGIUFWQIPSJNR-UHFFFAOYSA-N |
| Molecular Weight | 241.331 g/mol |
| SMILES | C1C(CCC1)C(NC(CC(C)C)C(OC)=O)=O |