CID 118838992

4-bromo-2-(bromomethyl)-6-methylpyridine hydrobromide

Structural Information

Molecular Formula
C7H7Br2N
SMILES
CC1=CC(=CC(=N1)CBr)Br
InChI
InChI=1S/C7H7Br2N/c1-5-2-6(9)3-7(4-8)10-5/h2-3H,4H2,1H3
InChIKey
QCJSKCMNRXQWEB-UHFFFAOYSA-N
Compound name
4-bromo-2-(bromomethyl)-6-methylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

262.89453 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.90181 130.1
[M+Na]+ 285.88375 142.2
[M-H]- 261.88725 136.3
[M+NH4]+ 280.92835 149.9
[M+K]+ 301.85769 127.1
[M+H-H2O]+ 245.89179 138.5
[M+HCOO]- 307.89273 146.4
[M+CH3COO]- 321.90838 199.2
[M+Na-2H]- 283.86920 138.9
[M]+ 262.89398 164.5
[M]- 262.89508 164.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe