CID 91317

Phenol, 2-(4-phenyl-2-quinazolinyl)-

Structural Information

Molecular Formula
C20H14N2O
SMILES
C1=CC=C(C=C1)C2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4O
InChI
InChI=1S/C20H14N2O/c23-18-13-7-5-11-16(18)20-21-17-12-6-4-10-15(17)19(22-20)14-8-2-1-3-9-14/h1-13,23H
InChIKey
ORJYTNKGOPMJPB-UHFFFAOYSA-N
Compound name
2-(4-phenylquinazolin-2-yl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

298.11063 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.11791 170.7
[M+Na]+ 321.09985 179.5
[M-H]- 297.10335 177.4
[M+NH4]+ 316.14445 182.7
[M+K]+ 337.07379 172.0
[M+H-H2O]+ 281.10789 159.7
[M+HCOO]- 343.10883 189.7
[M+CH3COO]- 357.12448 181.3
[M+Na-2H]- 319.08530 178.3
[M]+ 298.11008 169.2
[M]- 298.11118 169.2
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