CID 532065

2-chloro-n-(4-fluorophenyl)acetamide

Structural Information

Molecular Formula
C8H7ClFNO
SMILES
C1=CC(=CC=C1NC(=O)CCl)F
InChI
InChI=1S/C8H7ClFNO/c9-5-8(12)11-7-3-1-6(10)2-4-7/h1-4H,5H2,(H,11,12)
InChIKey
JDAWWCJBFPBHFL-UHFFFAOYSA-N
Compound name
2-chloro-N-(4-fluorophenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

280
Patents

187.02002 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.02730 133.8
[M+Na]+ 210.00924 146.1
[M+NH4]+ 205.05384 142.1
[M+K]+ 225.98318 139.4
[M-H]- 186.01274 135.0
[M+Na-2H]- 207.99469 140.7
[M]+ 187.01947 136.0
[M]- 187.02057 136.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe