CID 60719013

2416233-66-2

Structural Information

Molecular Formula
C11H13F3N2O
SMILES
C1=CC=C(C=C1)CN(CC(F)(F)F)C(=O)CN
InChI
InChI=1S/C11H13F3N2O/c12-11(13,14)8-16(10(17)6-15)7-9-4-2-1-3-5-9/h1-5H,6-8,15H2
InChIKey
NWPGEGSKUKDIFH-UHFFFAOYSA-N
Compound name
2-amino-N-benzyl-N-(2,2,2-trifluoroethyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.09799 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.10527 154.0
[M+Na]+ 269.08721 160.5
[M+NH4]+ 264.13181 158.8
[M+K]+ 285.06115 156.3
[M-H]- 245.09071 151.4
[M+Na-2H]- 267.07266 157.6
[M]+ 246.09744 153.7
[M]- 246.09854 153.7
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

No patent data available for this compound.