CID 200421

2-fluoro-n-[3-(trifluoromethyl)phenyl]benzamide

Structural Information

Molecular Formula
C14H9F4NO
SMILES
C1=CC=C(C(=C1)C(=O)NC2=CC=CC(=C2)C(F)(F)F)F
InChI
InChI=1S/C14H9F4NO/c15-12-7-2-1-6-11(12)13(20)19-10-5-3-4-9(8-10)14(16,17)18/h1-8H,(H,19,20)
InChIKey
FKRPWDOQYZQUKC-UHFFFAOYSA-N
Compound name
2-fluoro-N-[3-(trifluoromethyl)phenyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.062 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.06928 158.2
[M+Na]+ 306.05122 166.6
[M-H]- 282.05472 160.0
[M+NH4]+ 301.09582 173.6
[M+K]+ 322.02516 161.7
[M+H-H2O]+ 266.05926 147.5
[M+HCOO]- 328.06020 177.1
[M+CH3COO]- 342.07585 201.2
[M+Na-2H]- 304.03667 162.2
[M]+ 283.06145 152.2
[M]- 283.06255 152.2
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.