CID 831064

N-(3-methoxyphenyl)-3-(trifluoromethyl)benzamide

Structural Information

Molecular Formula
C15H12F3NO2
SMILES
COC1=CC=CC(=C1)NC(=O)C2=CC(=CC=C2)C(F)(F)F
InChI
InChI=1S/C15H12F3NO2/c1-21-13-7-3-6-12(9-13)19-14(20)10-4-2-5-11(8-10)15(16,17)18/h2-9H,1H3,(H,19,20)
InChIKey
SVJHYQPIYAKVLU-UHFFFAOYSA-N
Compound name
N-(3-methoxyphenyl)-3-(trifluoromethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.082 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.08928 163.2
[M+Na]+ 318.07122 171.0
[M-H]- 294.07472 166.2
[M+NH4]+ 313.11582 178.1
[M+K]+ 334.04516 166.9
[M+H-H2O]+ 278.07926 153.1
[M+HCOO]- 340.08020 183.0
[M+CH3COO]- 354.09585 203.5
[M+Na-2H]- 316.05667 167.3
[M]+ 295.08145 160.1
[M]- 295.08255 160.1
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.