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]+ 389.045426 190.7
[M+Na]+ 411.027368 197.1
[M-H]- 387.030874 200.4
[M+NH4]+ 406.071973 202.6
[M+K]+ 427.001308 191.9
[M+H-H2O]+ 371.035410 183.2
[M+HCOO]- 433.036351 204.9
[M+CH3COO]- 447.052001 219.4
[M+Na-2H]- 409.012816 191.1
[M]+ 388.03760142 194.8
[M]- 388.03869858 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.