| SpectraBase Spectrum ID |
64OADzYYRo4 |
| Name |
L-Norvaline, N-trifluoroacetyl-, pentadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
423.296028638 u |
| Formula |
C22H40F3NO3 |
| InChI |
InChI=1S/C22H40F3NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-18-29-20(27)19(17-4-2)26-21(28)22(23,24)25/h19H,3-18H2,1-2H3,(H,26,28) |
| InChIKey |
HLMKGGQCDKMJQF-UHFFFAOYSA-N |
| Molecular Weight |
423.561 g/mol |
| SMILES |
CCCCCCCCCCCCCCCOC(C(NC(C(F)(F)F)=O)CCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.901612 |
