| SpectraBase Spectrum ID |
DljndjcPX5E |
| Name |
Methyl 4-fluoro benzoate |
| CAS Registry Number |
403-33-8 |
| Classification |
Designer drug side product |
| 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 |
154.043007626 u |
| Formula |
C8H7FO2 |
| InChI |
InChI=1S/C8H7FO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3 |
| InChIKey |
MSEBQGULDWDIRW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
154.140 g/mol |
| Nominal Mass |
154 u |
| Quality |
991 |
| Retention Index |
1049 |
| SMILES |
C=1(C(OC)=O)C=CC(=CC1)F |
| SPLASH |
splash10-00di-8900000000-d35ba42df751b1def6d7 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Methyl 4-fluorobenzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_029976 |
