CID 14595225

130284-56-9

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

43
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 126.8
[M+Na]+ 229.89787 141.3
[M-H]- 205.90137 131.3
[M+NH4]+ 224.94247 148.8
[M+K]+ 245.87181 128.8
[M+H-H2O]+ 189.90591 128.2
[M+HCOO]- 251.90685 143.3
[M+CH3COO]- 265.92250 178.3
[M+Na-2H]- 227.88332 136.1
[M]+ 206.90810 146.5
[M]- 206.90920 146.5
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