CID 3118306

N-{1-[(2,3-dichlorophenyl)amino]-2-oxo-2-phenylethyl}furan-2-carboxamide

Structural Information

Molecular Formula
C19H14Cl2N2O3
SMILES
C1=CC=C(C=C1)C(=O)C(NC2=C(C(=CC=C2)Cl)Cl)NC(=O)C3=CC=CO3
InChI
InChI=1S/C19H14Cl2N2O3/c20-13-8-4-9-14(16(13)21)22-18(17(24)12-6-2-1-3-7-12)23-19(25)15-10-5-11-26-15/h1-11,18,22H,(H,23,25)
InChIKey
ROSIOVJMTFPOKI-UHFFFAOYSA-N
Compound name
N-[1-(2,3-dichloroanilino)-2-oxo-2-phenylethyl]furan-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

388.03815 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.04543 190.7
[M+Na]+ 411.02737 197.1
[M-H]- 387.03087 200.4
[M+NH4]+ 406.07197 202.6
[M+K]+ 427.00131 191.9
[M+H-H2O]+ 371.03541 183.2
[M+HCOO]- 433.03635 204.9
[M+CH3COO]- 447.05200 219.4
[M+Na-2H]- 409.01282 191.1
[M]+ 388.03760 194.8
[M]- 388.03870 194.8
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.