CID 67655

344-62-7

Structural Information

Molecular Formula
C9H8F3NO
SMILES
CC(=O)NC1=CC=CC=C1C(F)(F)F
InChI
InChI=1S/C9H8F3NO/c1-6(14)13-8-5-3-2-4-7(8)9(10,11)12/h2-5H,1H3,(H,13,14)
InChIKey
OXDTZGRSCDEKGO-UHFFFAOYSA-N
Compound name
N-[2-(trifluoromethyl)phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

7
References

144
Patents

203.0558 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.06308 144.7
[M+Na]+ 226.04502 153.1
[M+NH4]+ 221.08962 150.2
[M+K]+ 242.01896 148.4
[M-H]- 202.04852 141.9
[M+Na-2H]- 224.03047 148.9
[M]+ 203.05525 144.8
[M]- 203.05635 144.8
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