| SpectraBase Spectrum ID |
AFraxOjbwcA |
| Name |
ala-his, N,N'-di(Ethoxycarbonyl)-, methyl ester (isomer 2) |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
384.164499122 u |
| Formula |
C16H24N4O7 |
| InChI |
InChI=1S/C16H24N4O7/c1-5-26-15(23)18-10(3)13(21)19-12(14(22)25-4)7-11-8-20(9-17-11)16(24)27-6-2/h8-10,12H,5-7H2,1-4H3,(H,18,23)(H,19,21) |
| InChIKey |
GBKZBBXXNZTVFL-UHFFFAOYSA-N |
| Molecular Weight |
384.389 g/mol |
| SMILES |
C(=O)(C(NC(OCC)=O)C)NC(C(=O)OC)CC=1N=CN(C1)C(OCC)=O |
