CID 122235928

2-bromo-5-chloro-4-cyclopropylpyridine

Structural Information

Molecular Formula
C8H7BrClN
SMILES
C1CC1C2=CC(=NC=C2Cl)Br
InChI
InChI=1S/C8H7BrClN/c9-8-3-6(5-1-2-5)7(10)4-11-8/h3-5H,1-2H2
InChIKey
BAQYBXBSBUNXTF-UHFFFAOYSA-N
Compound name
2-bromo-5-chloro-4-cyclopropylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.94504 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.952316 138.1
[M+Na]+ 253.934258 153.4
[M-H]- 229.937764 147.0
[M+NH4]+ 248.978863 155.2
[M+K]+ 269.908198 140.5
[M+H-H2O]+ 213.942300 137.9
[M+HCOO]- 275.943241 155.6
[M+CH3COO]- 289.958891 153.7
[M+Na-2H]- 251.919706 146.4
[M]+ 230.94449142 159.2
[M]- 230.94558858 159.2
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

No patent data available for this compound.