| SpectraBase Compound ID | HJuBHibnvLN |
|---|---|
| InChI | InChI=1S/C19H35NO3/c1-14(2)8-7-13-23-19(22)18(15(3)4)20-17(21)12-11-16-9-5-6-10-16/h14-16,18H,5-13H2,1-4H3,(H,20,21) |
| InChIKey | OLTOEUYUDQEXLC-UHFFFAOYSA-N |
| Mol Weight | 325.5 g/mol |
| Molecular Formula | C19H35NO3 |
| Exact Mass | 325.261694 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 1LHrISdOgVf |
|---|---|
| Name | L-Valine, N-(3-cyclopentylpropionyl)-, isohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 325.261693988 u |
| Formula | C19H35NO3 |
| InChI | InChI=1S/C19H35NO3/c1-14(2)8-7-13-23-19(22)18(15(3)4)20-17(21)12-11-16-9-5-6-10-16/h14-16,18H,5-13H2,1-4H3,(H,20,21) |
| InChIKey | OLTOEUYUDQEXLC-UHFFFAOYSA-N |
| Molecular Weight | 325.493 g/mol |
| SMILES | C1CCCC1CCC(NC(C(C)C)C(=O)OCCCC(C)C)=O |