CID 12684342

2-chloro-n,n-dimethylquinazolin-4-amine

Structural Information

Molecular Formula
C10H10ClN3
SMILES
CN(C)C1=NC(=NC2=CC=CC=C21)Cl
InChI
InChI=1S/C10H10ClN3/c1-14(2)9-7-5-3-4-6-8(7)12-10(11)13-9/h3-6H,1-2H3
InChIKey
DTTPDWSQHPZGEY-UHFFFAOYSA-N
Compound name
2-chloro-N,N-dimethylquinazolin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

122
Patents

207.05632 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.06360 141.6
[M+Na]+ 230.04554 152.0
[M-H]- 206.04904 145.0
[M+NH4]+ 225.09014 160.5
[M+K]+ 246.01948 148.2
[M+H-H2O]+ 190.05358 134.2
[M+HCOO]- 252.05452 160.0
[M+CH3COO]- 266.07017 155.1
[M+Na-2H]- 228.03099 150.4
[M]+ 207.05577 145.0
[M]- 207.05687 145.0
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