CID 243582

N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide

Structural Information

Molecular Formula
C9H7ClF3NO
SMILES
CC(=O)NC1=C(C=CC(=C1)C(F)(F)F)Cl
InChI
InChI=1S/C9H7ClF3NO/c1-5(15)14-8-4-6(9(11,12)13)2-3-7(8)10/h2-4H,1H3,(H,14,15)
InChIKey
KQBBIJPLOXRSLZ-UHFFFAOYSA-N
Compound name
N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

237.01683 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.02411 147.2
[M+Na]+ 260.00605 156.5
[M+NH4]+ 255.05065 152.9
[M+K]+ 275.97999 151.4
[M-H]- 236.00955 144.5
[M+Na-2H]- 257.99150 151.4
[M]+ 237.01628 147.7
[M]- 237.01738 147.7
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