CID 3020368

N-(4-acetyl-2-fluorophenyl)acetamide

Structural Information

Molecular Formula
C10H10FNO2
SMILES
CC(=O)C1=CC(=C(C=C1)NC(=O)C)F
InChI
InChI=1S/C10H10FNO2/c1-6(13)8-3-4-10(9(11)5-8)12-7(2)14/h3-5H,1-2H3,(H,12,14)
InChIKey
VTSRUHHYVDPFBT-UHFFFAOYSA-N
Compound name
N-(4-acetyl-2-fluorophenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

195.06955 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.076826 138.8
[M+Na]+ 218.058768 146.9
[M-H]- 194.062274 141.7
[M+NH4]+ 213.103373 158.2
[M+K]+ 234.032708 145.1
[M+H-H2O]+ 178.066810 132.1
[M+HCOO]- 240.067751 161.9
[M+CH3COO]- 254.083401 187.5
[M+Na-2H]- 216.044216 142.3
[M]+ 195.06900142 138.1
[M]- 195.07009858 138.1
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

patents stripe