| SpectraBase Spectrum ID |
GUQmqkE7z4i |
| Name |
Ethanolamine TFA (N,O) |
| CAS Registry Number |
121119-58-2 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
253.017362000 u |
| Formula |
C6H5F6NO3 |
| InChI |
InChI=1S/C6H5F6NO3/c7-5(8,9)3(14)13-1-2-16-4(15)6(10,11)12/h1-2H2,(H,13,14) |
| InChIKey |
YDQHOULJYAFDRM-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
253.100 g/mol |
| Nominal Mass |
253 u |
| Quality |
1000 |
| Retention Index |
1764 |
| SMILES |
C(C(F)(F)F)(NCCOC(C(F)(F)F)=O)=O |
| SPLASH |
splash10-004i-8900000000-92a12e72f32a4a4c321b |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2-((trifluoroacetyl)amino)ethyl trifluoroacetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_019259 |
