CID 82651141

2-[(methylamino)methyl]pyridin-4-ol

Structural Information

Molecular Formula
C7H10N2O
SMILES
CNCC1=CC(=O)C=CN1
InChI
InChI=1S/C7H10N2O/c1-8-5-6-4-7(10)2-3-9-6/h2-4,8H,5H2,1H3,(H,9,10)
InChIKey
NTMFMGRUDZJRIP-UHFFFAOYSA-N
Compound name
2-(methylaminomethyl)-1H-pyridin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

138.07932 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.08660 125.9
[M+Na]+ 161.06854 134.2
[M-H]- 137.07204 127.2
[M+NH4]+ 156.11314 145.6
[M+K]+ 177.04248 131.5
[M+H-H2O]+ 121.07658 119.8
[M+HCOO]- 183.07752 149.8
[M+CH3COO]- 197.09317 172.4
[M+Na-2H]- 159.05399 134.4
[M]+ 138.07877 124.1
[M]- 138.07987 124.1
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

No patent data available for this compound.