| SpectraBase Compound ID | AejbTl8OgFk |
|---|---|
| InChI | InChI=1S/C17H25NO4/c1-12(2)10-21-16(19)15(13(3)4)18-17(20)22-11-14-8-6-5-7-9-14/h5-9,12-13,15H,10-11H2,1-4H3,(H,18,20) |
| InChIKey | WHFJEOWYZCGMJL-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 | 8CVHdWuAYYL |
|---|---|
| Name | L-Valine, N-benzyloxycarbonyl-, isobutyl 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/c1-12(2)10-21-16(19)15(13(3)4)18-17(20)22-11-14-8-6-5-7-9-14/h5-9,12-13,15H,10-11H2,1-4H3,(H,18,20) |
| InChIKey | WHFJEOWYZCGMJL-UHFFFAOYSA-N |
| Molecular Weight | 307.390 g/mol |
| SMILES | C(NC(OCC1=CC=CC=C1)=O)(C(OCC(C)C)=O)C(C)C |