CID 15342142

152803-24-2

Structural Information

Molecular Formula
C6H4N2O
SMILES
C1=C(C=NC=C1O)C#N
InChI
InChI=1S/C6H4N2O/c7-2-5-1-6(9)4-8-3-5/h1,3-4,9H
InChIKey
KAXIYYPIORYZLB-UHFFFAOYSA-N
Compound name
5-hydroxypyridine-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

314
Patents

120.032364 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 121.039640 121.1
[M+Na]+ 143.021582 131.9
[M-H]- 119.025088 122.1
[M+NH4]+ 138.066187 139.5
[M+K]+ 158.995522 129.5
[M+H-H2O]+ 103.029624 108.8
[M+HCOO]- 165.030565 140.4
[M+CH3COO]- 179.046215 180.3
[M+Na-2H]- 141.007030 129.1
[M]+ 120.03181542 115.2
[M]- 120.03291258 115.2
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