CID 603610

2,6-bis(bromomethyl)pyridine

Structural Information

Molecular Formula
C7H7Br2N
SMILES
C1=CC(=NC(=C1)CBr)CBr
InChI
InChI=1S/C7H7Br2N/c8-4-6-2-1-3-7(5-9)10-6/h1-3H,4-5H2
InChIKey
QUTSYCOAZVHGGT-UHFFFAOYSA-N
Compound name
2,6-bis(bromomethyl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

1285
Patents

262.89453 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.90181 130.7
[M+Na]+ 285.88375 142.1
[M-H]- 261.88725 136.6
[M+NH4]+ 280.92835 150.2
[M+K]+ 301.85769 127.0
[M+H-H2O]+ 245.89179 139.1
[M+HCOO]- 307.89273 147.1
[M+CH3COO]- 321.90838 198.3
[M+Na-2H]- 283.86920 140.0
[M]+ 262.89398 164.9
[M]- 262.89508 164.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe