CID 611660

6,7-dichloroquinazolin-2-amine

Structural Information

Molecular Formula
C8H5Cl2N3
SMILES
C1=C2C=NC(=NC2=CC(=C1Cl)Cl)N
InChI
InChI=1S/C8H5Cl2N3/c9-5-1-4-3-12-8(11)13-7(4)2-6(5)10/h1-3H,(H2,11,12,13)
InChIKey
OGBCMMGCLNFANJ-UHFFFAOYSA-N
Compound name
6,7-dichloroquinazolin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.98605 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.99333 138.7
[M+Na]+ 235.97527 155.3
[M+NH4]+ 231.01987 148.4
[M+K]+ 251.94921 147.0
[M-H]- 211.97877 141.7
[M+Na-2H]- 233.96072 146.9
[M]+ 212.98550 142.6
[M]- 212.98660 142.6
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

No patent data available for this compound.