| SpectraBase Spectrum ID |
8IXNgtAlBX6 |
| Name |
N-tfa-L-Prolylglutamic acid dibutyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
452.213421209 u |
| Formula |
C20H31F3N2O6 |
| InChI |
InChI=1S/C20H31F3N2O6/c1-3-5-12-30-16(26)10-9-14(18(28)31-13-6-4-2)24-17(27)15-8-7-11-25(15)19(29)20(21,22)23/h14-15H,3-13H2,1-2H3,(H,24,27)/t14-,15-/m0/s1 |
| InChIKey |
GGNYRZWLZVBSTL-GJZGRUSLSA-N |
| Molecular Weight |
452.471 g/mol |
| SMILES |
C(N1[C@](C(N[C@](C(=O)OCCCC)(CCC(=O)OCCCC)[H])=O)(CCC1)[H])(C(F)(F)F)=O |
