| SpectraBase Spectrum ID |
JIF8LwjNg5A |
| Name |
1-(3-Methylphenyl)-2,2-dibromohexan-1-one |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
345.956791134 u |
| Formula |
C13H16Br2O |
| InChI |
InChI=1S/C13H16Br2O/c1-3-4-8-13(14,15)12(16)11-7-5-6-10(2)9-11/h5-7,9H,3-4,8H2,1-2H3 |
| InChIKey |
BDACOMMYVNMCII-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
348.078 g/mol |
| Nominal Mass |
346 u |
| Quality |
997 |
| Retention Index |
2156 |
| SMILES |
C(C(C=1C=C(C=CC1)C)=O)(CCCC)(Br)Br |
| SPLASH |
splash10-014i-2900000000-e53a39467b0d36f91cc1 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2,2-dibromo-1-(3-methylphenyl)hexan-1-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002331 |
