CID 5004877

3-(phenylmethylidene)-1h,2h,3h-cyclopenta[b]quinoline-9-carboxylic acid

Structural Information

Molecular Formula
C20H15NO2
SMILES
C1CC2=C(C3=CC=CC=C3N=C2C1=CC4=CC=CC=C4)C(=O)O
InChI
InChI=1S/C20H15NO2/c22-20(23)18-15-8-4-5-9-17(15)21-19-14(10-11-16(18)19)12-13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,22,23)
InChIKey
YOJABMSUQZRPTE-UHFFFAOYSA-N
Compound name
3-benzylidene-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

301.1103 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.11758 170.8
[M+Na]+ 324.09952 185.7
[M+NH4]+ 319.14412 179.7
[M+K]+ 340.07346 178.8
[M-H]- 300.10302 175.2
[M+Na-2H]- 322.08497 177.7
[M]+ 301.10975 174.2
[M]- 301.11085 174.2
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.