| SpectraBase Compound ID | K32t7pZCUGx |
|---|---|
| InChI | InChI=1S/C17H25NO4/c1-5-11-21-16(19)15(13(2)3)18(4)17(20)22-12-14-9-7-6-8-10-14/h6-10,13,15H,5,11-12H2,1-4H3 |
| InChIKey | DWBUSODNYGZATP-UHFFFAOYSA-N |
| Mol Weight | 307.39 g/mol |
| Molecular Formula | C17H25NO4 |
| Exact Mass | 307.178358 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6RRLfjwluV5 |
|---|---|
| Name | Valine, N-methyl-N-benzyloxycarbonyl-, propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 307.178358285 u |
| Formula | C17H25NO4 |
| InChI | InChI=1S/C17H25NO4/c1-5-11-21-16(19)15(13(2)3)18(4)17(20)22-12-14-9-7-6-8-10-14/h6-10,13,15H,5,11-12H2,1-4H3 |
| InChIKey | DWBUSODNYGZATP-UHFFFAOYSA-N |
| Molecular Weight | 307.390 g/mol |
| SMILES | C1=CC=CC=C1COC(N(C(C(C)C)C(OCCC)=O)C)=O |