| SpectraBase Spectrum ID |
JJfNf6br0Do |
| Name |
2-Fluorophenylacetic acid |
| CAS Registry Number |
451-82-1 |
| 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 |
154.043007626 u |
| Formula |
C8H7FO2 |
| InChI |
InChI=1S/C8H7FO2/c9-7-4-2-1-3-6(7)5-8(10)11/h1-4H,5H2,(H,10,11) |
| InChIKey |
RPTRFSADOICSSK-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
154.140 g/mol |
| Nominal Mass |
154 u |
| Quality |
988 |
| Retention Index |
1424 |
| SMILES |
OC(CC=1C(=CC=CC1)F)=O |
| SPLASH |
splash10-0a4i-6900000000-d080c86f4c188569cc91 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Benzeneaceticacid,2-fluoro-
(2-Fluorophenyl)acetic acid |
| Technique |
GC/MS |
| Wiley ID |
DD2024_026504 |
