CID 29503

19216-53-6

Structural Information

Molecular Formula

C₁₂H₁₆N₄O₂

SMILES

CN(C)C1=NC2=CC(=C(C=C2C(=N1)N)OC)OC

InChI

InChI=1S/C12H16N4O2/c1-16(2)12-14-8-6-10(18-4)9(17-3)5-7(8)11(13)15-12/h5-6H,1-4H3,(H2,13,14,15)

InChIKey

JALPLGVFZRCLGE-UHFFFAOYSA-N

Compound name

6,7-dimethoxy-2-N,2-N-dimethylquinazoline-2,4-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 15
Patents: 248.12732 Da
Monoisotopic Mass: 1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	249.13460	155.4
[M+Na]+	271.11654	168.2
[M+NH4]+	266.16114	162.7
[M+K]+	287.09048	162.7
[M-H]-	247.12004	158.0
[M+Na-2H]-	269.10199	161.3
[M]+	248.12677	157.8
[M]-	248.12787	157.8

Literature stripe

literature stripe

Patent stripe

patents stripe