CID 72183184

5-amino-4-methylpyridin-3-ol

Structural Information

Molecular Formula
C6H8N2O
SMILES
CC1=C(C=NC=C1N)O
InChI
InChI=1S/C6H8N2O/c1-4-5(7)2-8-3-6(4)9/h2-3,9H,7H2,1H3
InChIKey
DXWDYBKOHYMMHL-UHFFFAOYSA-N
Compound name
5-amino-4-methylpyridin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

124.06366 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.07094 122.7
[M+Na]+ 147.05288 132.0
[M-H]- 123.05638 124.0
[M+NH4]+ 142.09748 143.0
[M+K]+ 163.02682 129.9
[M+H-H2O]+ 107.06092 117.0
[M+HCOO]- 169.06186 146.1
[M+CH3COO]- 183.07751 170.7
[M+Na-2H]- 145.03833 129.9
[M]+ 124.06311 120.6
[M]- 124.06421 120.6
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