CID 306568

N-(4-fluorophenyl)-4-nitrobenzamide

Structural Information

Molecular Formula
C13H9FN2O3
SMILES
C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)F)[N+](=O)[O-]
InChI
InChI=1S/C13H9FN2O3/c14-10-3-5-11(6-4-10)15-13(17)9-1-7-12(8-2-9)16(18)19/h1-8H,(H,15,17)
InChIKey
IKNWALBEQFNHIW-UHFFFAOYSA-N
Compound name
N-(4-fluorophenyl)-4-nitrobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

260.05972 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.06700 152.0
[M+Na]+ 283.04894 165.2
[M+NH4]+ 278.09354 159.2
[M+K]+ 299.02288 161.5
[M-H]- 259.05244 156.3
[M+Na-2H]- 281.03439 160.3
[M]+ 260.05917 154.8
[M]- 260.06027 154.8
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

patents stripe