| SpectraBase Spectrum ID |
LSAtDsCjMh4 |
| Name |
L-Leucyl-L-leucine, N-pentafluoropropionyl-, heptadecyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
628.423849134 u |
| Formula |
C32H57F5N2O4 |
| InChI |
InChI=1S/C32H57F5N2O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-43-29(41)27(23-25(4)5)38-28(40)26(22-24(2)3)39-30(42)31(33,34)32(35,36)37/h24-27H,6-23H2,1-5H3,(H,38,40)(H,39,42) |
| InChIKey |
VUNABLXCJDZHGZ-UHFFFAOYSA-N |
| Molecular Weight |
628.810 g/mol |
| SMILES |
C(CCCCCCCCCCCCCCOC(C(NC(C(NC(C(C(F)(F)F)(F)F)=O)CC(C)C)=O)CC(C)C)=O)CC |
