CID 4639371

4-methyl-2-(2-naphthyl)benzo(h)quinoline

Structural Information

Molecular Formula
C24H17N
SMILES
CC1=CC(=NC2=C1C=CC3=CC=CC=C32)C4=CC5=CC=CC=C5C=C4
InChI
InChI=1S/C24H17N/c1-16-14-23(20-11-10-17-6-2-3-8-19(17)15-20)25-24-21(16)13-12-18-7-4-5-9-22(18)24/h2-15H,1H3
InChIKey
LDBYBWFHJBBIOD-UHFFFAOYSA-N
Compound name
4-methyl-2-naphthalen-2-ylbenzo[h]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

319.1361 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.143376 177.4
[M+Na]+ 342.125318 188.0
[M-H]- 318.128824 185.6
[M+NH4]+ 337.169923 193.0
[M+K]+ 358.099258 179.3
[M+H-H2O]+ 302.133360 166.4
[M+HCOO]- 364.134301 196.9
[M+CH3COO]- 378.149951 188.6
[M+Na-2H]- 340.110766 186.6
[M]+ 319.13555142 178.6
[M]- 319.13664858 178.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.