CID 22111313

N-[1-(2-fluorophenyl)-2-oxopropyl]acetamide

Structural Information

Molecular Formula
C11H12FNO2
SMILES
CC(=O)C(C1=CC=CC=C1F)NC(=O)C
InChI
InChI=1S/C11H12FNO2/c1-7(14)11(13-8(2)15)9-5-3-4-6-10(9)12/h3-6,11H,1-2H3,(H,13,15)
InChIKey
AWFWQFVIIBYOKY-UHFFFAOYSA-N
Compound name
N-[1-(2-fluorophenyl)-2-oxopropyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

209.0852 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.09248 144.3
[M+Na]+ 232.07442 150.8
[M-H]- 208.07792 146.7
[M+NH4]+ 227.11902 162.7
[M+K]+ 248.04836 149.3
[M+H-H2O]+ 192.08246 137.3
[M+HCOO]- 254.08340 166.1
[M+CH3COO]- 268.09905 190.3
[M+Na-2H]- 230.05987 146.7
[M]+ 209.08465 142.9
[M]- 209.08575 142.9
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