CID 676352

177355-84-9

Structural Information

Molecular Formula
C22H20N4
SMILES
C1=CC=C(C=C1)CNC2=NC(=NC3=CC=CC=C32)NCC4=CC=CC=C4
InChI
InChI=1S/C22H20N4/c1-3-9-17(10-4-1)15-23-21-19-13-7-8-14-20(19)25-22(26-21)24-16-18-11-5-2-6-12-18/h1-14H,15-16H2,(H2,23,24,25,26)
InChIKey
QAIMUUJJAJBPCL-UHFFFAOYSA-N
Compound name
2-N,4-N-dibenzylquinazoline-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

40
References

240
Patents

340.1688 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.17608 179.5
[M+Na]+ 363.15802 185.3
[M-H]- 339.16152 186.5
[M+NH4]+ 358.20262 189.5
[M+K]+ 379.13196 177.4
[M+H-H2O]+ 323.16606 167.4
[M+HCOO]- 385.16700 201.2
[M+CH3COO]- 399.18265 188.7
[M+Na-2H]- 361.14347 188.9
[M]+ 340.16825 177.5
[M]- 340.16935 177.5
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