CID 819821

2-chloro-5-hydroxypyridine

Structural Information

Molecular Formula
C5H4ClNO
SMILES
C1=CC(=NC=C1O)Cl
InChI
InChI=1S/C5H4ClNO/c6-5-2-1-4(8)3-7-5/h1-3,8H
InChIKey
KVCOOWROABTXDJ-UHFFFAOYSA-N
Compound name
6-chloropyridin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

2234
Patents

128.99814 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.005416 118.5
[M+Na]+ 151.987358 128.9
[M-H]- 127.990864 120.0
[M+NH4]+ 147.031963 139.7
[M+K]+ 167.961298 125.6
[M+H-H2O]+ 111.995400 113.9
[M+HCOO]- 173.996341 137.3
[M+CH3COO]- 188.011991 166.2
[M+Na-2H]- 149.972806 127.4
[M]+ 128.99759142 119.3
[M]- 128.99868858 119.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe