CID 295763

2-methylpyrimidin-4-amine

Structural Information

Molecular Formula
C5H7N3
SMILES
CC1=NC=CC(=N1)N
InChI
InChI=1S/C5H7N3/c1-4-7-3-2-5(6)8-4/h2-3H,1H3,(H2,6,7,8)
InChIKey
GKVDLTTVBNOGNJ-UHFFFAOYSA-N
Compound name
2-methylpyrimidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

753
Patents

109.063995 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 110.07127 118.7
[M+Na]+ 132.05321 131.8
[M+NH4]+ 127.09782 127.2
[M+K]+ 148.02715 126.0
[M-H]- 108.05672 120.6
[M+Na-2H]- 130.03866 126.6
[M]+ 109.06345 121.0
[M]- 109.06454 121.0
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