| SpectraBase Spectrum ID |
5hEzrj8hc7H |
| Name |
L-pro-L-tyr, N,o-di(Ethoxycarbonyl)-, methyl ester (isomer 2) |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
436.184565862 u |
| Formula |
C21H28N2O8 |
| InChI |
InChI=1S/C21H28N2O8/c1-4-29-20(26)23-12-6-7-17(23)18(24)22-16(19(25)28-3)13-14-8-10-15(11-9-14)31-21(27)30-5-2/h8-11,16-17H,4-7,12-13H2,1-3H3,(H,22,24) |
| InChIKey |
ITFPGIPBEYYWDR-UHFFFAOYSA-N |
| Molecular Weight |
436.461 g/mol |
| SMILES |
C(C1N(CCC1)C(OCC)=O)(=O)NC(C(=O)OC)CC1=CC=C(C=C1)OC(OCC)=O |
