CID 30858556

N1-(2-fluorophenyl)benzene-1,4-dicarboxamide

Structural Information

Molecular Formula
C14H11FN2O2
SMILES
C1=CC=C(C(=C1)NC(=O)C2=CC=C(C=C2)C(=O)N)F
InChI
InChI=1S/C14H11FN2O2/c15-11-3-1-2-4-12(11)17-14(19)10-7-5-9(6-8-10)13(16)18/h1-8H,(H2,16,18)(H,17,19)
InChIKey
JHJXHRQFWLJWDP-UHFFFAOYSA-N
Compound name
4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.08044 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.087716 156.0
[M+Na]+ 281.069658 162.8
[M-H]- 257.073164 161.3
[M+NH4]+ 276.114263 171.6
[M+K]+ 297.043598 159.0
[M+H-H2O]+ 241.077700 147.3
[M+HCOO]- 303.078641 179.6
[M+CH3COO]- 317.094291 199.9
[M+Na-2H]- 279.055106 159.3
[M]+ 258.07989142 152.5
[M]- 258.08098858 152.5
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.