| SpectraBase Compound ID | 7YdkFU0iSZD |
|---|---|
| InChI | InChI=1S/C22H30N4O5/c1-21(2,3)31-20(29)26-22(4,12-15-9-7-6-8-10-15)19(28)25-17(18(27)30-5)11-16-13-23-14-24-16/h6-10,13-14,17H,11-12H2,1-5H3,(H,23,24)(H,25,28)(H,26,29)/t17-,22+/m0/s1 |
| InChIKey | UWQQHFYUVGKCFF-HTAPYJJXSA-N |
| Mol Weight | 430.51 g/mol |
| Molecular Formula | C22H30N4O5 |
| Exact Mass | 430.22162 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CFWXR14Rvya |
|---|---|
| Name | (S-(R*,R*))-N-(2-(((1,1-DIMETHYL)-ETHOXYCARBONYL)-AMINO)-2-METHYL-1-OXO-3-PHENYLPROPYL)-HISTIDINE-METHYLESTER |
| Compound Number | 18A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H30N4O5 |
| InChI | InChI=1S/C22H30N4O5/c1-21(2,3)31-20(29)26-22(4,12-15-9-7-6-8-10-15)19(28)25-17(18(27)30-5)11-16-13-23-14-24-16/h6-10,13-14,17H,11-12H2,1-5H3,(H,23,24)(H,25,28)(H,26,29)/t17-,22+/m0/s1 |
| InChIKey | UWQQHFYUVGKCFF-HTAPYJJXSA-N |
| Literature Reference Author | CR.NOE,A.WEIGAND,S.PIRKER,P.LIEPERT |
| Literature Reference Citation | MH.CHEM.,128,301(1997) |
| Literature Reference DOI | 10.1007/BF00807896 |
| Molecular Weight | 430.504 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRJ29 |