CID 7275250

853331-40-5

Structural Information

Molecular Formula
C17H10ClF2NO2
SMILES
C1=CC=C(C(=C1)C2=CC=C(O2)C(=O)NC3=C(C=C(C=C3)F)F)Cl
InChI
InChI=1S/C17H10ClF2NO2/c18-12-4-2-1-3-11(12)15-7-8-16(23-15)17(22)21-14-6-5-10(19)9-13(14)20/h1-9H,(H,21,22)
InChIKey
CXTVDCSQOLPADG-UHFFFAOYSA-N
Compound name
5-(2-chlorophenyl)-N-(2,4-difluorophenyl)furan-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

333.0368 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.04408 173.3
[M+Na]+ 356.02602 183.7
[M-H]- 332.02952 182.0
[M+NH4]+ 351.07062 188.2
[M+K]+ 371.99996 177.9
[M+H-H2O]+ 316.03406 164.3
[M+HCOO]- 378.03500 191.8
[M+CH3COO]- 392.05065 185.4
[M+Na-2H]- 354.01147 174.8
[M]+ 333.03625 175.0
[M]- 333.03735 175.1
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.