CID 21846358

4-chloro-6-cyclopropylpyrimidin-2-amine

Structural Information

Molecular Formula
C7H8ClN3
SMILES
C1CC1C2=CC(=NC(=N2)N)Cl
InChI
InChI=1S/C7H8ClN3/c8-6-3-5(4-1-2-4)10-7(9)11-6/h3-4H,1-2H2,(H2,9,10,11)
InChIKey
KXBBHTZHROZBCL-UHFFFAOYSA-N
Compound name
4-chloro-6-cyclopropylpyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

67
Patents

169.04068 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.04796 132.2
[M+Na]+ 192.02990 147.5
[M+NH4]+ 187.07450 141.6
[M+K]+ 208.00384 142.2
[M-H]- 168.03340 142.1
[M+Na-2H]- 190.01535 142.9
[M]+ 169.04013 138.5
[M]- 169.04123 138.5
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