CID 768760

N-(2-fluorophenyl)-3-methyl-1-benzofuran-2-carboxamide

Structural Information

Molecular Formula
C16H12FNO2
SMILES
CC1=C(OC2=CC=CC=C12)C(=O)NC3=CC=CC=C3F
InChI
InChI=1S/C16H12FNO2/c1-10-11-6-2-5-9-14(11)20-15(10)16(19)18-13-8-4-3-7-12(13)17/h2-9H,1H3,(H,18,19)
InChIKey
VHKCJMQVBUTXLG-UHFFFAOYSA-N
Compound name
N-(2-fluorophenyl)-3-methyl-1-benzofuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.0852 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.092476 158.3
[M+Na]+ 292.074418 168.5
[M-H]- 268.077924 166.5
[M+NH4]+ 287.119023 176.2
[M+K]+ 308.048358 164.9
[M+H-H2O]+ 252.082460 150.5
[M+HCOO]- 314.083401 182.7
[M+CH3COO]- 328.099051 171.8
[M+Na-2H]- 290.059866 163.9
[M]+ 269.08465142 160.6
[M]- 269.08574858 160.6
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.