| SpectraBase Spectrum ID |
3K9px26zm4t |
| Name |
(Z)-N-(2-benzamido-4-((tert-butoxycarbonyl)amino)-2-butenoyl)-L-leucine Methyl Ester |
| Appearance |
Syrup |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
447.236935789 u |
| Formula |
C23H33N3O6 |
| InChI |
InChI=1S/C23H33N3O6/c1-15(2)14-18(21(29)31-6)26-20(28)17(12-13-24-22(30)32-23(3,4)5)25-19(27)16-10-8-7-9-11-16/h7-12,15,18H,13-14H2,1-6H3,(H,24,30)(H,25,27)(H,26,28)/b17-12-/t18-/m0/s1 |
| InChIKey |
GODUZPQZQBCLAE-FSEPTYSPSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201703758 |
| Molecular Weight |
447.532 g/mol |
| Optical Rotation |
[a]D = -4 (c = 0.28, CHCl3) |
| Quality |
20 |
| Reported Formula |
C23H33N3O6 |
| SMILES |
N(C\C=C/(C(N[C@](C(OC)=O)(CC(C)C)[H])=O)NC(=O)C=1C=CC=CC1)C(=O)OC(C)(C)C |
| SPLASH |
splash10-0a4i-0901000000-cca35e1c14a4b4ef7c20 |
| Sample Comments |
Z/E = 90:10 |
| Source of Spectrum |
QE-24-SM11-19d (DOI: 10.1002/chem.201703758) |
| Wiley ID |
1901492 |
