CID 944058

5-(2-chlorophenyl)-n-(4-fluorophenyl)-2-furamide

Structural Information

Molecular Formula
C17H11ClFNO2
SMILES
C1=CC=C(C(=C1)C2=CC=C(O2)C(=O)NC3=CC=C(C=C3)F)Cl
InChI
InChI=1S/C17H11ClFNO2/c18-14-4-2-1-3-13(14)15-9-10-16(22-15)17(21)20-12-7-5-11(19)6-8-12/h1-10H,(H,20,21)
InChIKey
LOKXMXPQBBOLFY-UHFFFAOYSA-N
Compound name
5-(2-chlorophenyl)-N-(4-fluorophenyl)furan-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

315.04623 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.053506 170.7
[M+Na]+ 338.035448 180.1
[M-H]- 314.038954 180.4
[M+NH4]+ 333.080053 186.1
[M+K]+ 354.009388 174.8
[M+H-H2O]+ 298.043490 162.5
[M+HCOO]- 360.044431 190.2
[M+CH3COO]- 374.060081 183.0
[M+Na-2H]- 336.020896 173.4
[M]+ 315.04568142 173.0
[M]- 315.04677858 173.0
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