CID 72213999

2-bromo-4-chloropyridin-3-ol

Structural Information

Molecular Formula
C5H3BrClNO
SMILES
C1=CN=C(C(=C1Cl)O)Br
InChI
InChI=1S/C5H3BrClNO/c6-5-4(9)3(7)1-2-8-5/h1-2,9H
InChIKey
XZMRRLPLIHBBQA-UHFFFAOYSA-N
Compound name
2-bromo-4-chloropyridin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

206.90865 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.91593 130.8
[M+Na]+ 229.89787 136.1
[M+NH4]+ 224.94247 136.2
[M+K]+ 245.87181 135.6
[M-H]- 205.90137 131.0
[M+Na-2H]- 227.88332 135.3
[M]+ 206.90810 130.7
[M]- 206.90920 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

patents stripe