CID 3439494

2-chloro-n-{[(2,3,4-trifluorophenyl)carbamoyl]methyl}propanamide

Structural Information

Molecular Formula
C11H10ClF3N2O2
SMILES
CC(C(=O)NCC(=O)NC1=C(C(=C(C=C1)F)F)F)Cl
InChI
InChI=1S/C11H10ClF3N2O2/c1-5(12)11(19)16-4-8(18)17-7-3-2-6(13)9(14)10(7)15/h2-3,5H,4H2,1H3,(H,16,19)(H,17,18)
InChIKey
UDEKLBHATAMXDF-UHFFFAOYSA-N
Compound name
2-chloro-N-[2-oxo-2-(2,3,4-trifluoroanilino)ethyl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.0383 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.04558 158.4
[M+Na]+ 317.02752 165.7
[M+NH4]+ 312.07212 162.5
[M+K]+ 333.00146 161.7
[M-H]- 293.03102 155.3
[M+Na-2H]- 315.01297 160.7
[M]+ 294.03775 158.2
[M]- 294.03885 158.2
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.