CID 2388902

N,n'-bis(2-fluorophenyl)propanediamide

Structural Information

Molecular Formula
C15H12F2N2O2
SMILES
C1=CC=C(C(=C1)NC(=O)CC(=O)NC2=CC=CC=C2F)F
InChI
InChI=1S/C15H12F2N2O2/c16-10-5-1-3-7-12(10)18-14(20)9-15(21)19-13-8-4-2-6-11(13)17/h1-8H,9H2,(H,18,20)(H,19,21)
InChIKey
YBFCTDUWOLIFKW-UHFFFAOYSA-N
Compound name
N,N'-bis(2-fluorophenyl)propanediamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

6
Patents

290.08667 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.09395 163.1
[M+Na]+ 313.07589 169.5
[M-H]- 289.07939 167.2
[M+NH4]+ 308.12049 177.6
[M+K]+ 329.04983 165.4
[M+H-H2O]+ 273.08393 153.1
[M+HCOO]- 335.08487 185.9
[M+CH3COO]- 349.10052 205.5
[M+Na-2H]- 311.06134 166.3
[M]+ 290.08612 159.7
[M]- 290.08722 159.7
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.