CID 13981970

2,4-dimethylpyrimidin-5-amine

Structural Information

Molecular Formula
C6H9N3
SMILES
CC1=NC(=NC=C1N)C
InChI
InChI=1S/C6H9N3/c1-4-6(7)3-8-5(2)9-4/h3H,7H2,1-2H3
InChIKey
TULVCIOMQCBNRL-UHFFFAOYSA-N
Compound name
2,4-dimethylpyrimidin-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

107
Patents

123.07965 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.08693 123.2
[M+Na]+ 146.06887 136.5
[M+NH4]+ 141.11347 131.6
[M+K]+ 162.04281 130.6
[M-H]- 122.07237 125.1
[M+Na-2H]- 144.05432 130.6
[M]+ 123.07910 125.5
[M]- 123.08020 125.5
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