CID 10728712

4-chloro-6,7-dimethoxyquinazolin-2-amine

Structural Information

Molecular Formula
C10H10ClN3O2
SMILES
COC1=C(C=C2C(=C1)C(=NC(=N2)N)Cl)OC
InChI
InChI=1S/C10H10ClN3O2/c1-15-7-3-5-6(4-8(7)16-2)13-10(12)14-9(5)11/h3-4H,1-2H3,(H2,12,13,14)
InChIKey
CIRYMDFNFDJALS-UHFFFAOYSA-N
Compound name
4-chloro-6,7-dimethoxyquinazolin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

239.04616 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.053436 148.9
[M+Na]+ 262.035378 160.8
[M-H]- 238.038884 151.2
[M+NH4]+ 257.079983 166.1
[M+K]+ 278.009318 156.6
[M+H-H2O]+ 222.043420 142.0
[M+HCOO]- 284.044361 166.5
[M+CH3COO]- 298.060011 193.9
[M+Na-2H]- 260.020826 155.9
[M]+ 239.04561142 153.7
[M]- 239.04670858 153.7
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