CID 16776987

Benzo[f]quinoline-5-carboxylic acid

Structural Information

Molecular Formula
C14H9NO2
SMILES
C1=CC=C2C3=C(C(=CC2=C1)C(=O)O)N=CC=C3
InChI
InChI=1S/C14H9NO2/c16-14(17)12-8-9-4-1-2-5-10(9)11-6-3-7-15-13(11)12/h1-8H,(H,16,17)
InChIKey
JYDYBSVBTZVOSI-UHFFFAOYSA-N
Compound name
benzo[f]quinoline-5-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.06332 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.07060 145.9
[M+Na]+ 246.05254 162.6
[M+NH4]+ 241.09714 155.4
[M+K]+ 262.02648 154.6
[M-H]- 222.05604 149.2
[M+Na-2H]- 244.03799 154.5
[M]+ 223.06277 149.4
[M]- 223.06387 149.4
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.