| SpectraBase Spectrum ID |
5rpySgpEcvr |
| Name |
L-Glutamic acid, N-trifluoroacetyl-, dimethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
271.066756974 u |
| Formula |
C9H12F3NO5 |
| InChI |
InChI=1S/C9H12F3NO5/c1-17-6(14)4-3-5(7(15)18-2)13-8(16)9(10,11)12/h5H,3-4H2,1-2H3,(H,13,16) |
| InChIKey |
JNCMGGUGJSCRBR-UHFFFAOYSA-N |
| Molecular Weight |
271.192 g/mol |
| SMILES |
COC(CCC(C(OC)=O)NC(C(F)(F)F)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971327 |
