SpectraBase Spectrum ID |
5sgTV7QmSH1 |
Name |
Trifluoroacetic acid |
CAS Registry Number |
76-05-1 |
Classification |
Chemical
Derivat. agent |
Comments |
Original RI info: <1000* |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
113.992863759 u |
Formula |
C2HF3O2 |
InChI |
InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7) |
InChIKey |
DTQVDTLACAAQTR-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
114.023 g/mol |
SMILES |
C(C(=O)O)(F)(F)F |
SPLASH |
splash10-0fr2-9000000000-843336cf529c26ac769d |
Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
Technique |
GC/MS |
Wiley ID |
MMPW6e_5547 |