| SpectraBase Compound ID | 2lwuaKPG07O |
|---|---|
| InChI | InChI=1S/C22H33N3O6/c1-14(2)18(25-21(29)31-22(4,5)6)20(28)24-15(3)19(27)23-12-17(26)30-13-16-10-8-7-9-11-16/h7-11,14-15,18H,12-13H2,1-6H3,(H,23,27)(H,24,28)(H,25,29) |
| InChIKey | RCNUXOFODHOCQF-UHFFFAOYSA-N |
| Mol Weight | 435.5 g/mol |
| Molecular Formula | C22H33N3O6 |
| Exact Mass | 435.236936 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 | AW66HyeBEwK |
|---|---|
| Name | boc-val-ala-gly-Och2Ph |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 435.236935789 u |
| Formula | C22H33N3O6 |
| InChI | InChI=1S/C22H33N3O6/c1-14(2)18(25-21(29)31-22(4,5)6)20(28)24-15(3)19(27)23-12-17(26)30-13-16-10-8-7-9-11-16/h7-11,14-15,18H,12-13H2,1-6H3,(H,23,27)(H,24,28)(H,25,29) |
| InChIKey | RCNUXOFODHOCQF-UHFFFAOYSA-N |
| Molecular Weight | 435.521 g/mol |
| SMILES | C(NC(C(NCC(=O)OCC=1C=CC=CC1)=O)C)(C(NC(OC(C)(C)C)=O)C(C)C)=O |