CID 11116742

3-(2-bromoethyl)pyridine hydrobromide

Structural Information

Molecular Formula
C7H8BrN
SMILES
C1=CC(=CN=C1)CCBr
InChI
InChI=1S/C7H8BrN/c8-4-3-7-2-1-5-9-6-7/h1-2,5-6H,3-4H2
InChIKey
CKOBWUTTZOFETQ-UHFFFAOYSA-N
Compound name
3-(2-bromoethyl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

164
Patents

184.98401 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.99129 130.4
[M+Na]+ 207.97323 134.9
[M+NH4]+ 203.01783 136.2
[M+K]+ 223.94717 133.8
[M-H]- 183.97673 131.4
[M+Na-2H]- 205.95868 135.7
[M]+ 184.98346 130.2
[M]- 184.98456 130.2
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