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]+ 287.117906 166.8
[M+Na]+ 309.099848 178.8
[M-H]- 285.103354 173.4
[M+NH4]+ 304.144453 181.8
[M+K]+ 325.073788 171.5
[M+H-H2O]+ 269.107890 156.4
[M+HCOO]- 331.108831 187.6
[M+CH3COO]- 345.124481 179.0
[M+Na-2H]- 307.085296 176.1
[M]+ 286.11008142 169.3
[M]- 286.11117858 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.