| SpectraBase Spectrum ID |
SG4hUv6LRz |
| Name |
L-Norvaline, N-trifluoroacetyl-, heptadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
451.327328767 u |
| Formula |
C24H44F3NO3 |
| InChI |
InChI=1S/C24H44F3NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-31-22(29)21(19-4-2)28-23(30)24(25,26)27/h21H,3-20H2,1-2H3,(H,28,30) |
| InChIKey |
HTUDPNUMAQXNKH-UHFFFAOYSA-N |
| Molecular Weight |
451.615 g/mol |
| SMILES |
CCCCCCCCCCCCCCCCCOC(C(NC(C(F)(F)F)=O)CCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.832702 |
