| SpectraBase Spectrum ID |
JFZorJrPUbg |
| Name |
Vanillin TFA |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
248.029643190 u |
| Formula |
C10H7F3O4 |
| InChI |
InChI=1S/C10H7F3O4/c1-16-8-4-6(5-14)2-3-7(8)17-9(15)10(11,12)13/h2-5H,1H3 |
| InChIKey |
CZRDEKBEQVBOMB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
248.157 g/mol |
| Nominal Mass |
248 u |
| Quality |
943 |
| Retention Index |
1749 |
| SMILES |
C=1(C(=CC(=CC1)C=O)OC)OC(C(F)(F)F)=O |
| SPLASH |
splash10-0002-9340000000-e313220fa3417ac7389c |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-formyl-2-methoxyphenyl trifluoroacetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_026887 |
