CID 4122435

6,7-dimethoxyquinazoline-2,4-diamine

Structural Information

Molecular Formula
C10H12N4O2
SMILES
COC1=C(C=C2C(=C1)C(=NC(=N2)N)N)OC
InChI
InChI=1S/C10H12N4O2/c1-15-7-3-5-6(4-8(7)16-2)13-10(12)14-9(5)11/h3-4H,1-2H3,(H4,11,12,13,14)
InChIKey
ZCIPYVXKMWNKLZ-UHFFFAOYSA-N
Compound name
6,7-dimethoxyquinazoline-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

37
Patents

220.09602 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.10330 147.6
[M+Na]+ 243.08524 158.0
[M-H]- 219.08874 149.6
[M+NH4]+ 238.12984 164.1
[M+K]+ 259.05918 155.0
[M+H-H2O]+ 203.09328 139.8
[M+HCOO]- 265.09422 170.3
[M+CH3COO]- 279.10987 194.8
[M+Na-2H]- 241.07069 154.5
[M]+ 220.09547 148.7
[M]- 220.09657 148.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe