| SpectraBase Compound ID | KOFHyvT0JeP |
|---|---|
| InChI | InChI=1S/C18H35NO4/c1-6-8-10-12-14-23-18(21)19(5)16(15(3)4)17(20)22-13-11-9-7-2/h15-16H,6-14H2,1-5H3 |
| InChIKey | MZZJVHLIQXVPNN-UHFFFAOYSA-N |
| Mol Weight | 329.5 g/mol |
| Molecular Formula | C18H35NO4 |
| Exact Mass | 329.256609 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5ji3bRlKXUG |
|---|---|
| Name | dl-Valine, N-methyl-N-hexyloxycarbonyl-, pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 329.256608607 u |
| Formula | C18H35NO4 |
| InChI | InChI=1S/C18H35NO4/c1-6-8-10-12-14-23-18(21)19(5)16(15(3)4)17(20)22-13-11-9-7-2/h15-16H,6-14H2,1-5H3 |
| InChIKey | MZZJVHLIQXVPNN-UHFFFAOYSA-N |
| Molecular Weight | 329.481 g/mol |
| SMILES | C(C(C(OCCCCC)=O)N(C)C(=O)OCCCCCC)(C)C |