| SpectraBase Compound ID | 8IA9n4Mvy0j |
|---|---|
| InChI | InChI=1S/C22H25N3O6/c1-30-21(28)18(12-15-8-4-2-5-9-15)24-20(27)17(13-19(23)26)25-22(29)31-14-16-10-6-3-7-11-16/h2-11,17-18H,12-14H2,1H3,(H2,23,26)(H,24,27)(H,25,29)/t17-,18-/m0/s1 |
| InChIKey | XHINWMJGDYTIFM-ROUUACIJSA-N |
| Mol Weight | 427.46 g/mol |
| Molecular Formula | C22H25N3O6 |
| Exact Mass | 427.174336 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KO4XFvhMmve |
|---|---|
| Name | N-(N2-carboxy-L-asparaginyl)-L-3-phenylalanine, N2-benzyl methyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H25N3O6 |
| InChI | InChI=1S/C22H25N3O6/c1-30-21(28)18(12-15-8-4-2-5-9-15)24-20(27)17(13-19(23)26)25-22(29)31-14-16-10-6-3-7-11-16/h2-11,17-18H,12-14H2,1H3,(H2,23,26)(H,24,27)(H,25,29)/t17-,18-/m0/s1 |
| InChIKey | XHINWMJGDYTIFM-ROUUACIJSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 50685M |
| Solvent | DMSO-d6 |