CID 207822

30831-91-5

Structural Information

Molecular Formula
C16H14N2O
SMILES
C1C=CC2=CC=CC=C2N1C(=O)NC3=CC=CC=C3
InChI
InChI=1S/C16H14N2O/c19-16(17-14-9-2-1-3-10-14)18-12-6-8-13-7-4-5-11-15(13)18/h1-11H,12H2,(H,17,19)
InChIKey
NUTCGOHCGOZXLH-UHFFFAOYSA-N
Compound name
N-phenyl-2H-quinoline-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.11061 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.117886 155.7
[M+Na]+ 273.099828 161.9
[M-H]- 249.103334 161.4
[M+NH4]+ 268.144433 171.6
[M+K]+ 289.073768 157.2
[M+H-H2O]+ 233.107870 146.8
[M+HCOO]- 295.108811 176.9
[M+CH3COO]- 309.124461 167.0
[M+Na-2H]- 271.085276 163.5
[M]+ 250.11006142 152.8
[M]- 250.11115858 152.8
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.