This information is based on the molecular structure shown on the left side. For a decoupled sample, please refer to its individual details.

Formula: C6H6Br2N2


Canonical SMILES:
Nc1cc(Br)c(cc1N)Br
InChI:
InChI=1S/C6H6Br2N2/c7-3-1-5(9)6(10)2-4(3)8/h1-2H,9-10H2
InChIKey:
TTXGKCVKGXHPRI-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2021-11-19This work is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.

 

mass spectrometry (MS) 
Author: Jérôme Klein1

1. Institute of Biological and Chemical Systems - IBCS-FMS, Karlsruhe Institute of Technology, Germany

Analysis DOI:
Analysis ID:
Content:   
MS (EI, 70 eV, 80 °C), m/z (%) : 348 (10), 346 (28), 344 (29), 342 (10), 268/266/264 (49/100/49) [M]+, 78 (13). HRMS–EI (m/z): [M]+ calcd for C6H6N279Br2 263.8898; found 263.8892.
Datasets