CID 67694

N-(4-fluoro-3-nitrophenyl)acetamide

Structural Information

Molecular Formula
C8H7FN2O3
SMILES
CC(=O)NC1=CC(=C(C=C1)F)[N+](=O)[O-]
InChI
InChI=1S/C8H7FN2O3/c1-5(12)10-6-2-3-7(9)8(4-6)11(13)14/h2-4H,1H3,(H,10,12)
InChIKey
KLHCAOSRFFAKQV-UHFFFAOYSA-N
Compound name
N-(4-fluoro-3-nitrophenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

159
Patents

198.04407 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.05135 135.3
[M+Na]+ 221.03329 146.7
[M+NH4]+ 216.07789 142.1
[M+K]+ 237.00723 144.6
[M-H]- 197.03679 136.9
[M+Na-2H]- 219.01874 140.7
[M]+ 198.04352 136.9
[M]- 198.04462 136.9
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

patents stripe