| SpectraBase Spectrum ID |
8IarWUGziEK |
| Name |
3-Bromoacetophenone |
| CAS Registry Number |
2142-63-4 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
197.968027844 u |
| Formula |
C8H7BrO |
| InChI |
InChI=1S/C8H7BrO/c1-6(10)7-3-2-4-8(9)5-7/h2-5H,1H3 |
| InChIKey |
JYAQYXOVOHJRCS-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
199.047 g/mol |
| Nominal Mass |
198 u |
| Quality |
1000 |
| Retention Index |
1291 |
| SMILES |
C=1(C(=O)C)C=C(C=CC1)Br |
| SPLASH |
splash10-0kar-4910000000-e6fad79279a6527cb77d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-Acetyl-3-bromobenzene
Ethanone,1-(3-bromophenyl)-
m-Bromoacetophenone
1-(3-bromophenyl)ethan-1-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_022762 |
