CID 129958246

Pyridine, 6-bromo-3-chloro-2-ethynyl-

Structural Information

Molecular Formula
C7H3BrClN
SMILES
C#CC1=C(C=CC(=N1)Br)Cl
InChI
InChI=1S/C7H3BrClN/c1-2-6-5(9)3-4-7(8)10-6/h1,3-4H
InChIKey
OYQKGUQFDKQSGI-UHFFFAOYSA-N
Compound name
6-bromo-3-chloro-2-ethynylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.91374 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.92102 132.8
[M+Na]+ 237.90296 139.1
[M+NH4]+ 232.94756 135.8
[M+K]+ 253.87690 134.9
[M-H]- 213.90646 127.0
[M+Na-2H]- 235.88841 135.5
[M]+ 214.91319 130.7
[M]- 214.91429 130.7
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.