CID 45080112

2-cyclopropylpyrimidin-4-amine

Structural Information

Molecular Formula
C7H9N3
SMILES
C1CC1C2=NC=CC(=N2)N
InChI
InChI=1S/C7H9N3/c8-6-3-4-9-7(10-6)5-1-2-5/h3-5H,1-2H2,(H2,8,9,10)
InChIKey
IIUUNXSYGPXQGX-UHFFFAOYSA-N
Compound name
2-cyclopropylpyrimidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

113
Patents

135.07965 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.08693 131.1
[M+Na]+ 158.06887 141.6
[M-H]- 134.07237 135.9
[M+NH4]+ 153.11347 145.1
[M+K]+ 174.04281 137.9
[M+H-H2O]+ 118.07691 123.3
[M+HCOO]- 180.07785 154.8
[M+CH3COO]- 194.09350 144.3
[M+Na-2H]- 156.05432 139.1
[M]+ 135.07910 131.0
[M]- 135.08020 131.0
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