CID 63384

3445-50-9

Structural Information

Molecular Formula
C19H14N2O
SMILES
CC1=NC2=CC=CC=C2C(=O)N1C3=CC4=CC=CC=C4C=C3
InChI
InChI=1S/C19H14N2O/c1-13-20-18-9-5-4-8-17(18)19(22)21(13)16-11-10-14-6-2-3-7-15(14)12-16/h2-12H,1H3
InChIKey
LYMXQANZNHVUJE-UHFFFAOYSA-N
Compound name
2-methyl-3-naphthalen-2-ylquinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

286.11063 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.11791 166.8
[M+Na]+ 309.09985 178.8
[M-H]- 285.10335 173.4
[M+NH4]+ 304.14445 181.8
[M+K]+ 325.07379 171.5
[M+H-H2O]+ 269.10789 156.4
[M+HCOO]- 331.10883 187.6
[M+CH3COO]- 345.12448 179.0
[M+Na-2H]- 307.08530 176.1
[M]+ 286.11008 169.3
[M]- 286.11118 169.3
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

No patent data available for this compound.