CID 24212805

853331-44-9

Structural Information

Molecular Formula
C23H16ClNO3
SMILES
C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C3=CC=C(O3)C4=CC=CC=C4Cl
InChI
InChI=1S/C23H16ClNO3/c24-20-9-5-4-8-19(20)21-14-15-22(28-21)23(26)25-16-10-12-18(13-11-16)27-17-6-2-1-3-7-17/h1-15H,(H,25,26)
InChIKey
XKTMHVYSQUVUJI-UHFFFAOYSA-N
Compound name
5-(2-chlorophenyl)-N-(4-phenoxyphenyl)furan-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

389.08188 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 390.08916 193.0
[M+Na]+ 412.07110 200.7
[M-H]- 388.07460 206.6
[M+NH4]+ 407.11570 204.6
[M+K]+ 428.04504 195.2
[M+H-H2O]+ 372.07914 183.7
[M+HCOO]- 434.08008 212.8
[M+CH3COO]- 448.09573 203.9
[M+Na-2H]- 410.05655 195.2
[M]+ 389.08133 197.1
[M]- 389.08243 197.1
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.