| SpectraBase Compound ID | Ds9n183t2qy |
|---|---|
| InChI | InChI=1S/C19H29NO4/c1-5-6-12-23-18(21)17(13-15(2)3)20(4)19(22)24-14-16-10-8-7-9-11-16/h7-11,15,17H,5-6,12-14H2,1-4H3 |
| InChIKey | MCKNSDLNKOPESH-UHFFFAOYSA-N |
| Mol Weight | 335.44 g/mol |
| Molecular Formula | C19H29NO4 |
| Exact Mass | 335.209658 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DWPyURPgqKV |
|---|---|
| Name | L-Leucine, N-benzyloxycarbonyl-N-methyl-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 335.209658414 u |
| Formula | C19H29NO4 |
| InChI | InChI=1S/C19H29NO4/c1-5-6-12-23-18(21)17(13-15(2)3)20(4)19(22)24-14-16-10-8-7-9-11-16/h7-11,15,17H,5-6,12-14H2,1-4H3 |
| InChIKey | MCKNSDLNKOPESH-UHFFFAOYSA-N |
| Molecular Weight | 335.444 g/mol |
| SMILES | C1=CC=CC=C1COC(N(C(CC(C)C)C(OCCCC)=O)C)=O |