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]+ 259.08772 156.0
[M+Na]+ 281.06966 162.8
[M-H]- 257.07316 161.3
[M+NH4]+ 276.11426 171.6
[M+K]+ 297.04360 159.0
[M+H-H2O]+ 241.07770 147.3
[M+HCOO]- 303.07864 179.6
[M+CH3COO]- 317.09429 199.9
[M+Na-2H]- 279.05511 159.3
[M]+ 258.07989 152.5
[M]- 258.08099 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.