CID 210202

Brn 2783680

Structural Information

Molecular Formula
C20H14ClF3N2O
SMILES
C1=CC=C(C(=C1)C(=O)NC2=CC=CC=C2Cl)NC3=CC=CC(=C3)C(F)(F)F
InChI
InChI=1S/C20H14ClF3N2O/c21-16-9-2-4-11-18(16)26-19(27)15-8-1-3-10-17(15)25-14-7-5-6-13(12-14)20(22,23)24/h1-12,25H,(H,26,27)
InChIKey
WMLSNMAZALJHIJ-UHFFFAOYSA-N
Compound name
N-(2-chlorophenyl)-2-[3-(trifluoromethyl)anilino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

390.07468 Da
Monoisotopic Mass

7.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.08196 187.5
[M+Na]+ 413.06390 195.4
[M-H]- 389.06740 193.2
[M+NH4]+ 408.10850 198.8
[M+K]+ 429.03784 187.4
[M+H-H2O]+ 373.07194 176.2
[M+HCOO]- 435.07288 203.2
[M+CH3COO]- 449.08853 222.1
[M+Na-2H]- 411.04935 190.7
[M]+ 390.07413 184.8
[M]- 390.07523 184.8
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.