| SpectraBase Spectrum ID |
JFEnf2Hr7jM |
| Name |
4-Methoxyphenol TFA |
| CAS Registry Number |
5672-87-7 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
220.034728571 u |
| Formula |
C9H7F3O3 |
| InChI |
InChI=1S/C9H7F3O3/c1-14-6-2-4-7(5-3-6)15-8(13)9(10,11)12/h2-5H,1H3 |
| InChIKey |
USKCDUZMASNBCQ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
220.147 g/mol |
| Nominal Mass |
220 u |
| Quality |
987 |
| Retention Index |
1552 |
| SMILES |
C(C(F)(F)F)(OC=1C=CC(=CC1)OC)=O |
| SPLASH |
splash10-00di-9720000000-3cde66bf0fa56e031f1e |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-Methoxyphenol trifluoroacetate
4-methoxyphenyl trifluoroacetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_021699 |
