CID 18540774

4-amino-2-chloro-6,7-dimethylquinazoline

Structural Information

Molecular Formula
C10H10ClN3
SMILES
CC1=CC2=C(C=C1C)N=C(N=C2N)Cl
InChI
InChI=1S/C10H10ClN3/c1-5-3-7-8(4-6(5)2)13-10(11)14-9(7)12/h3-4H,1-2H3,(H2,12,13,14)
InChIKey
LBMRLXOTDIRNJN-UHFFFAOYSA-N
Compound name
2-chloro-6,7-dimethylquinazolin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

207.05632 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.06360 141.9
[M+Na]+ 230.04554 158.1
[M+NH4]+ 225.09014 151.3
[M+K]+ 246.01948 150.2
[M-H]- 206.04904 145.2
[M+Na-2H]- 228.03099 149.5
[M]+ 207.05577 145.6
[M]- 207.05687 145.6
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