SpectraBase Spectrum ID |
FHtTSHMfRJs |
Name |
L-Norvalyl-L-norvaline, N-isobutoxycarbonyl-, heptyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
414.309372455 u |
Formula |
C22H42N2O5 |
InChI |
InChI=1S/C22H42N2O5/c1-6-9-10-11-12-15-28-21(26)19(14-8-3)23-20(25)18(13-7-2)24-22(27)29-16-17(4)5/h17-19H,6-16H2,1-5H3,(H,23,25)(H,24,27) |
InChIKey |
SGKGMEMYCRAPFV-UHFFFAOYSA-N |
Molecular Weight |
414.587 g/mol |
SMILES |
CC(C)COC(NC(C(NC(C(OCCCCCCC)=O)CCC)=O)CCC)=O |