| SpectraBase Compound ID | 1GUpOKS5JXi |
|---|---|
| InChI | InChI=1S/C17H23NO4/c1-17(2,3)22-16(21)18-11-7-10-14(15(19)20)12-13-8-5-4-6-9-13/h4-10,14H,11-12H2,1-3H3,(H,18,21)(H,19,20)/b10-7+ |
| InChIKey | UHWRBBGPHKQDLH-JXMROGBWSA-N |
| Mol Weight | 305.37 g/mol |
| Molecular Formula | C17H23NO4 |
| Exact Mass | 305.162708 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 | 7Lortpeqhw0 |
|---|---|
| Name | (E)-2-Benzyl-5-(tert-butoxycarbonylamino)pent-3-enoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 305.162708221 u |
| Formula | C17H23NO4 |
| InChI | InChI=1S/C17H23NO4/c1-17(2,3)22-16(21)18-11-7-10-14(15(19)20)12-13-8-5-4-6-9-13/h4-10,14H,11-12H2,1-3H3,(H,18,21)(H,19,20)/b10-7+ |
| InChIKey | UHWRBBGPHKQDLH-JXMROGBWSA-N |
| SMILES | C(C(\C=C\CNC(=O)OC(C)(C)C)CC=1C=CC=CC1)(=O)O |