SpectraBase Spectrum ID |
GYdeMvuoy7E |
Name |
Pentafluoropropionic acid |
CAS Registry Number |
431-27-6 |
Classification |
Derivatizing agent |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
163.989670085 u |
Formula |
C3HF5O2 |
InChI |
InChI=1S/C3HF5O2/c4-2(5,1(9)10)3(6,7)8/h(H,9,10) |
InChIKey |
LRMSQVBRUNSOJL-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
164.031 g/mol |
Nominal Mass |
164 u |
Quality |
932 |
Retention Index |
1078 |
SMILES |
OC(C(C(F)(F)F)(F)F)=O |
SPLASH |
splash10-0gba-9500000000-60b4d8a22c7e515ae02f |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
2,2,3,3,3-Pentafluoropropanoic acid |
Technique |
GC/MS |
Wiley ID |
DD2024_010680 |