CID 9832

404-41-1

Structural Information

Molecular Formula
C8H7ClFNO
SMILES
C1=CC(=CC=C1NC(=O)CF)Cl
InChI
InChI=1S/C8H7ClFNO/c9-6-1-3-7(4-2-6)11-8(12)5-10/h1-4H,5H2,(H,11,12)
InChIKey
UOJROUJTMBCWCR-UHFFFAOYSA-N
Compound name
N-(4-chlorophenyl)-2-fluoroacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

42
Patents

187.02002 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.027296 134.0
[M+Na]+ 210.009238 142.9
[M-H]- 186.012744 136.6
[M+NH4]+ 205.053843 154.5
[M+K]+ 225.983178 139.0
[M+H-H2O]+ 170.017280 128.4
[M+HCOO]- 232.018221 153.8
[M+CH3COO]- 246.033871 182.1
[M+Na-2H]- 207.994686 140.1
[M]+ 187.01947142 134.2
[M]- 187.02056858 134.2
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