SpectraBase Spectrum ID |
2meoubghndY |
Name |
Methyl 4-trifluoroacetyloxy benzoate |
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(14)6-2-4-7(5-3-6)17-9(15)10(11,12)13/h2-5H,1H3 |
InChIKey |
SOEHGZALKHKRFA-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
248.157 g/mol |
Nominal Mass |
248 u |
Quality |
1000 |
Retention Index |
1749 |
SMILES |
C(C(F)(F)F)(OC1=CC=C(C(OC)=O)C=C1)=O |
SPLASH |
splash10-014i-4290000000-c9b57cdce52cfc2f7215 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
methyl 4-((trifluoroacetyl)oxy)benzoate |
Technique |
GC/MS |
Wiley ID |
DD2024_027556 |