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]+ 270.09248 158.3
[M+Na]+ 292.07442 168.5
[M-H]- 268.07792 166.5
[M+NH4]+ 287.11902 176.2
[M+K]+ 308.04836 164.9
[M+H-H2O]+ 252.08246 150.5
[M+HCOO]- 314.08340 182.7
[M+CH3COO]- 328.09905 171.8
[M+Na-2H]- 290.05987 163.9
[M]+ 269.08465 160.6
[M]- 269.08575 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.