CID 86762217

4-amino-2-bromopyridin-3-ol

Structural Information

Molecular Formula
C5H5BrN2O
SMILES
C1=CN=C(C(=C1N)O)Br
InChI
InChI=1S/C5H5BrN2O/c6-5-4(9)3(7)1-2-8-5/h1-2,9H,(H2,7,8)
InChIKey
HPQFFWLPUAAAGR-UHFFFAOYSA-N
Compound name
4-amino-2-bromopyridin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

187.95853 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.96581 130.0
[M+Na]+ 210.94775 133.2
[M+NH4]+ 205.99235 134.6
[M+K]+ 226.92169 134.0
[M-H]- 186.95125 130.2
[M+Na-2H]- 208.93320 133.6
[M]+ 187.95798 129.2
[M]- 187.95908 129.2
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