CID 164163

124428-06-4

Structural Information

Molecular Formula
C20H16N2O
SMILES
C1=CC=C2C=C(C=CC2=C1)CCOC3=NC=NC4=CC=CC=C43
InChI
InChI=1S/C20H16N2O/c1-2-6-17-13-15(9-10-16(17)5-1)11-12-23-20-18-7-3-4-8-19(18)21-14-22-20/h1-10,13-14H,11-12H2
InChIKey
AORXZRJJRNHDPO-UHFFFAOYSA-N
Compound name
4-(2-naphthalen-2-ylethoxy)quinazoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

300.12625 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.13353 170.5
[M+Na]+ 323.11547 179.8
[M-H]- 299.11897 176.1
[M+NH4]+ 318.16007 184.3
[M+K]+ 339.08941 172.8
[M+H-H2O]+ 283.12351 159.5
[M+HCOO]- 345.12445 190.8
[M+CH3COO]- 359.14010 181.6
[M+Na-2H]- 321.10092 180.9
[M]+ 300.12570 173.1
[M]- 300.12680 173.1
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