CID 11063983

6-iodopyridin-3-ol

Structural Information

Molecular Formula
C5H4INO
SMILES
C1=CC(=NC=C1O)I
InChI
InChI=1S/C5H4INO/c6-5-2-1-4(8)3-7-5/h1-3,8H
InChIKey
UVNPCRNIHOCXEA-UHFFFAOYSA-N
Compound name
6-iodopyridin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

192
Patents

220.93376 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.94104 126.5
[M+Na]+ 243.92298 128.7
[M-H]- 219.92648 121.1
[M+NH4]+ 238.96758 142.4
[M+K]+ 259.89692 132.9
[M+H-H2O]+ 203.93102 117.4
[M+HCOO]- 265.93196 144.5
[M+CH3COO]- 279.94761 174.6
[M+Na-2H]- 241.90843 123.1
[M]+ 220.93321 123.0
[M]- 220.93431 123.0
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