CID 206382

6-chloro-2-(4-chlorophenyl)-4-phenylquinazoline

Structural Information

Molecular Formula
C20H12Cl2N2
SMILES
C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)C4=CC=C(C=C4)Cl
InChI
InChI=1S/C20H12Cl2N2/c21-15-8-6-14(7-9-15)20-23-18-11-10-16(22)12-17(18)19(24-20)13-4-2-1-3-5-13/h1-12H
InChIKey
UVXACOVKIACFRT-UHFFFAOYSA-N
Compound name
6-chloro-2-(4-chlorophenyl)-4-phenylquinazoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.03775 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.04503 179.6
[M+Na]+ 373.02697 190.9
[M-H]- 349.03047 186.3
[M+NH4]+ 368.07157 191.9
[M+K]+ 389.00091 181.4
[M+H-H2O]+ 333.03501 168.8
[M+HCOO]- 395.03595 190.0
[M+CH3COO]- 409.05160 190.0
[M+Na-2H]- 371.01242 185.3
[M]+ 350.03720 182.7
[M]- 350.03830 182.7
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

No patent data available for this compound.