CID 265776

2-methylaminopyrimidine

Structural Information

Molecular Formula
C5H7N3
SMILES
CNC1=NC=CC=N1
InChI
InChI=1S/C5H7N3/c1-6-5-7-3-2-4-8-5/h2-4H,1H3,(H,6,7,8)
InChIKey
BQNXHDSGGRTFNX-UHFFFAOYSA-N
Compound name
N-methylpyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

720
Patents

109.063995 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 110.07127 118.8
[M+Na]+ 132.05321 131.8
[M+NH4]+ 127.09782 127.5
[M+K]+ 148.02715 125.5
[M-H]- 108.05672 120.8
[M+Na-2H]- 130.03866 127.4
[M]+ 109.06345 121.1
[M]- 109.06454 121.1
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