| SpectraBase Spectrum ID |
5GdEzCRljM |
| Name |
4-Methylcatechol TFA |
| Classification |
Biomolecule |
| Comments |
Original RI info: <1000* |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
220.034728571 u |
| Formula |
C9H7F3O3 |
| InChI |
InChI=1S/C9H7F3O3/c1-5-2-3-7(6(13)4-5)15-8(14)9(10,11)12/h2-4,13H,1H3 |
| InChIKey |
SZWBCFHALFKSAB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
220.147 g/mol |
| SMILES |
c1cc(c(cc1C)O)OC(C(F)(F)F)=O |
| SPLASH |
splash10-00xr-9410000000-8881c3e015f50401355b |
| 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_5987 |
