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]+ 301.133526 170.5
[M+Na]+ 323.115468 179.8
[M-H]- 299.118974 176.1
[M+NH4]+ 318.160073 184.3
[M+K]+ 339.089408 172.8
[M+H-H2O]+ 283.123510 159.5
[M+HCOO]- 345.124451 190.8
[M+CH3COO]- 359.140101 181.6
[M+Na-2H]- 321.100916 180.9
[M]+ 300.12570142 173.1
[M]- 300.12679858 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