CID 4060333

N6,n6-dimethyl-9h-purine-2,6-diamine

Structural Information

Molecular Formula
C7H10N6
SMILES
CN(C)C1=NC(=NC2=C1NC=N2)N
InChI
InChI=1S/C7H10N6/c1-13(2)6-4-5(10-3-9-4)11-7(8)12-6/h3H,1-2H3,(H3,8,9,10,11,12)
InChIKey
GHILAORILZRWPO-UHFFFAOYSA-N
Compound name
6-N,6-N-dimethyl-7H-purine-2,6-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

164
Patents

178.0967 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.10398 134.5
[M+Na]+ 201.08592 146.3
[M+NH4]+ 196.13052 141.4
[M+K]+ 217.05986 143.7
[M-H]- 177.08942 135.1
[M+Na-2H]- 199.07137 140.6
[M]+ 178.09615 136.0
[M]- 178.09725 136.0
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