| SpectraBase Spectrum ID |
2edxvtTL6L2 |
| Name |
L-pro-L-tyr, N,o-di(Ethoxycarbonyl)-, ethyl ester (isomer 2) |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
450.200215926 u |
| Formula |
C22H30N2O8 |
| InChI |
InChI=1S/C22H30N2O8/c1-4-29-20(26)17(14-15-9-11-16(12-10-15)32-22(28)31-6-3)23-19(25)18-8-7-13-24(18)21(27)30-5-2/h9-12,17-18H,4-8,13-14H2,1-3H3,(H,23,25) |
| InChIKey |
VESPNNRTPQWNKL-UHFFFAOYSA-N |
| Molecular Weight |
450.488 g/mol |
| SMILES |
C(C1N(CCC1)C(OCC)=O)(=O)NC(C(=O)OCC)CC1=CC=C(C=C1)OC(OCC)=O |
