CID 4548326

476482-71-0

Structural Information

Molecular Formula
C24H23FN2O2
SMILES
CC1=CC=C(C=C1)C2C3=C(CCCC3=O)NC(=C2C(=O)NC4=CC(=CC=C4)F)C
InChI
InChI=1S/C24H23FN2O2/c1-14-9-11-16(12-10-14)22-21(24(29)27-18-6-3-5-17(25)13-18)15(2)26-19-7-4-8-20(28)23(19)22/h3,5-6,9-13,22,26H,4,7-8H2,1-2H3,(H,27,29)
InChIKey
WPFLHKPQQMUATH-UHFFFAOYSA-N
Compound name
N-(3-fluorophenyl)-2-methyl-4-(4-methylphenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

390.17435 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.18163 195.6
[M+Na]+ 413.16357 201.6
[M-H]- 389.16707 201.6
[M+NH4]+ 408.20817 205.3
[M+K]+ 429.13751 194.1
[M+H-H2O]+ 373.17161 184.1
[M+HCOO]- 435.17255 209.8
[M+CH3COO]- 449.18820 203.3
[M+Na-2H]- 411.14902 194.8
[M]+ 390.17380 189.9
[M]- 390.17490 189.9
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.