CID 207253

29485-14-1

Structural Information

Molecular Formula
C13H16F3N3O2
SMILES
CC(CC1=CC(=CC=C1)C(F)(F)F)NCC(=O)NC(=O)N
InChI
InChI=1S/C13H16F3N3O2/c1-8(18-7-11(20)19-12(17)21)5-9-3-2-4-10(6-9)13(14,15)16/h2-4,6,8,18H,5,7H2,1H3,(H3,17,19,20,21)
InChIKey
GAVCGCBEHJDRDJ-UHFFFAOYSA-N
Compound name
N-carbamoyl-2-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.11948 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.12676 165.6
[M+Na]+ 326.10870 169.6
[M+NH4]+ 321.15330 168.3
[M+K]+ 342.08264 167.1
[M-H]- 302.11220 161.8
[M+Na-2H]- 324.09415 166.9
[M]+ 303.11893 164.3
[M]- 303.12003 164.3
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.