CID 2665148

N-(3-chlorophenyl)-3-(3-fluorophenyl)-2-propenamide

Structural Information

Molecular Formula
C15H11ClFNO
SMILES
C1=CC(=CC(=C1)F)/C=C/C(=O)NC2=CC(=CC=C2)Cl
InChI
InChI=1S/C15H11ClFNO/c16-12-4-2-6-14(10-12)18-15(19)8-7-11-3-1-5-13(17)9-11/h1-10H,(H,18,19)/b8-7+
InChIKey
ZCVSFTCJXTVJRS-BQYQJAHWSA-N
Compound name
(E)-N-(3-chlorophenyl)-3-(3-fluorophenyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

275.05133 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.05861 159.4
[M+Na]+ 298.04055 168.0
[M-H]- 274.04405 164.8
[M+NH4]+ 293.08515 176.1
[M+K]+ 314.01449 161.2
[M+H-H2O]+ 258.04859 151.8
[M+HCOO]- 320.04953 178.5
[M+CH3COO]- 334.06518 198.4
[M+Na-2H]- 296.02600 163.5
[M]+ 275.05078 159.4
[M]- 275.05188 159.4
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.