| SpectraBase Compound ID | 3Xni9EEbh5L |
|---|---|
| InChI | InChI=1S/C25H32ClN5O8/c1-15(2)21(25(35)39-3)29-23(33)18(14-16-8-5-4-6-9-16)28-22(32)17(10-7-13-30(36)37)27-24(34)19-11-12-20(26)31(19)38/h4-6,8-9,11-12,15,17-18,21,38H,7,10,13-14H2,1-3H3,(H,27,34)(H,28,32)(H,29,33) |
| InChIKey | IBJFQPPBGBBLFA-UHFFFAOYSA-N |
| Mol Weight | 566.0 g/mol |
| Molecular Formula | C25H32ClN5O8 |
| Exact Mass | 565.193941 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fkc24SFKzVS |
|---|---|
| Name | CHPCA-(NO2)NVA-PHE-VAL-OME |
| Compound Number | 21A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H31ClN5O8 |
| InChI | InChI=1S/C25H32ClN5O8/c1-15(2)21(25(35)39-3)29-23(33)18(14-16-8-5-4-6-9-16)28-22(32)17(10-7-13-30(36)37)27-24(34)19-11-12-20(26)31(19)38/h4-6,8-9,11-12,15,17-18,21,38H,7,10,13-14H2,1-3H3,(H,27,34)(H,28,32)(H,29,33) |
| InChIKey | IBJFQPPBGBBLFA-UHFFFAOYSA-N |
| Literature Reference Author | B.D.ZLATOPOLSKIY,M.RADZOM,A.ZEECK,A.D.MEIJERE |
| Literature Reference Citation | EUR.J.ORG.CHEM.,1525(2006) |
| Molecular Weight | 565.003 g/mol |
| Sample ID | 43533 |
| Solvent | CDCl3 |