CID 50989702

7-bromopyrido[3,2-d]pyrimidin-4-amine

Structural Information

Molecular Formula
C7H5BrN4
SMILES
C1=C(C=NC2=C1N=CN=C2N)Br
InChI
InChI=1S/C7H5BrN4/c8-4-1-5-6(10-2-4)7(9)12-3-11-5/h1-3H,(H2,9,11,12)
InChIKey
DHGMEPSZSWBNLX-UHFFFAOYSA-N
Compound name
7-bromopyrido[3,2-d]pyrimidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.96976 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.97704 138.2
[M+Na]+ 246.95898 143.2
[M+NH4]+ 242.00358 143.1
[M+K]+ 262.93292 142.9
[M-H]- 222.96248 138.8
[M+Na-2H]- 244.94443 142.8
[M]+ 223.96921 137.9
[M]- 223.97031 137.9
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

No patent data available for this compound.