CID 2103995

747411-16-1

Structural Information

Molecular Formula
C14H15Cl2F3N2O2
SMILES
CC(C)N(CC(=O)NC1=C(C=C(C=C1)Cl)C(F)(F)F)C(=O)CCl
InChI
InChI=1S/C14H15Cl2F3N2O2/c1-8(2)21(13(23)6-15)7-12(22)20-11-4-3-9(16)5-10(11)14(17,18)19/h3-5,8H,6-7H2,1-2H3,(H,20,22)
InChIKey
NCFQQSCEJZFFBI-UHFFFAOYSA-N
Compound name
2-[(2-chloroacetyl)-propan-2-ylamino]-N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

0
Patents

370.04626 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.05354 172.8
[M+Na]+ 393.03548 179.5
[M+NH4]+ 388.08008 176.5
[M+K]+ 409.00942 175.8
[M-H]- 369.03898 169.2
[M+Na-2H]- 391.02093 174.9
[M]+ 370.04571 172.7
[M]- 370.04681 172.7
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

No patent data available for this compound.