CID 1351262

5-(2-chlorophenyl)-n-phenyl-2-furamide

Structural Information

Molecular Formula
C17H12ClNO2
SMILES
C1=CC=C(C=C1)NC(=O)C2=CC=C(O2)C3=CC=CC=C3Cl
InChI
InChI=1S/C17H12ClNO2/c18-14-9-5-4-8-13(14)15-10-11-16(21-15)17(20)19-12-6-2-1-3-7-12/h1-11H,(H,19,20)
InChIKey
LEPJYIMGRAIRJN-UHFFFAOYSA-N
Compound name
5-(2-chlorophenyl)-N-phenylfuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

297.05566 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.062936 168.0
[M+Na]+ 320.044878 176.5
[M-H]- 296.048384 178.8
[M+NH4]+ 315.089483 183.9
[M+K]+ 336.018818 171.6
[M+H-H2O]+ 280.052920 160.6
[M+HCOO]- 342.053861 188.6
[M+CH3COO]- 356.069511 180.6
[M+Na-2H]- 318.030326 172.1
[M]+ 297.05511142 170.9
[M]- 297.05620858 170.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.