CID 64008

138841-14-2

Structural Information

Molecular Formula
C20H16N2O2
SMILES
C1=CC=C2C=C(C=CC2=C1)OCCN3C=NC4=CC=CC=C4C3=O
InChI
InChI=1S/C20H16N2O2/c23-20-18-7-3-4-8-19(18)21-14-22(20)11-12-24-17-10-9-15-5-1-2-6-16(15)13-17/h1-10,13-14H,11-12H2
InChIKey
LPCHLQFOYKUQJP-UHFFFAOYSA-N
Compound name
3-(2-naphthalen-2-yloxyethyl)quinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

316.1212 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.12848 174.0
[M+Na]+ 339.11042 184.3
[M-H]- 315.11392 180.0
[M+NH4]+ 334.15502 187.3
[M+K]+ 355.08436 177.5
[M+H-H2O]+ 299.11846 163.0
[M+HCOO]- 361.11940 194.6
[M+CH3COO]- 375.13505 185.2
[M+Na-2H]- 337.09587 183.6
[M]+ 316.12065 177.7
[M]- 316.12175 177.7
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