CID 132059611

8-methylpyrido(3,2-d)pyrimidine-2,4-diamine

Structural Information

Molecular Formula
C8H9N5
SMILES
CC1=C2C(=NC=C1)C(=NC(=N2)N)N
InChI
InChI=1S/C8H9N5/c1-4-2-3-11-6-5(4)12-8(10)13-7(6)9/h2-3H,1H3,(H4,9,10,12,13)
InChIKey
KBYZYONAAPHCFD-UHFFFAOYSA-N
Compound name
8-methylpyrido[3,2-d]pyrimidine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

175.0858 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.09308 135.2
[M+Na]+ 198.07502 148.6
[M+NH4]+ 193.11962 143.0
[M+K]+ 214.04896 142.9
[M-H]- 174.07852 137.5
[M+Na-2H]- 196.06047 142.1
[M]+ 175.08525 137.6
[M]- 175.08635 137.6
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