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

17
Patents

239.04616 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.05344 148.9
[M+Na]+ 262.03538 160.8
[M-H]- 238.03888 151.2
[M+NH4]+ 257.07998 166.1
[M+K]+ 278.00932 156.6
[M+H-H2O]+ 222.04342 142.0
[M+HCOO]- 284.04436 166.5
[M+CH3COO]- 298.06001 193.9
[M+Na-2H]- 260.02083 155.9
[M]+ 239.04561 153.7
[M]- 239.04671 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