| SpectraBase Compound ID | 8mSGV3J4DhE |
|---|---|
| InChI | InChI=1S/C18H35NO4/c1-4-7-9-10-11-12-15-23-18(21)19-16(13-6-3)17(20)22-14-8-5-2/h16H,4-15H2,1-3H3,(H,19,21)/t16-/m0/s1 |
| InChIKey | IKUIIWZXXAQLKJ-INIZCTEOSA-N |
| Mol Weight | 329.5 g/mol |
| Molecular Formula | C18H35NO4 |
| Exact Mass | 329.256609 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 | 3SZ6Vd9sbg0 |
|---|---|
| Name | L-Norvaline, N-octyloxycarbonyl-, butyl 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/c1-4-7-9-10-11-12-15-23-18(21)19-16(13-6-3)17(20)22-14-8-5-2/h16H,4-15H2,1-3H3,(H,19,21)/t16-/m0/s1 |
| InChIKey | IKUIIWZXXAQLKJ-INIZCTEOSA-N |
| Molecular Weight | 329.481 g/mol |
| SMILES | CCC[C@@](C(OCCCC)=O)(NC(=O)OCCCCCCCC)[H] |