CID 2452155

N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(methylamino)acetamide hydrochloride

Structural Information

Molecular Formula
C10H10ClF3N2O
SMILES
CNCC(=O)NC1=CC(=C(C=C1)Cl)C(F)(F)F
InChI
InChI=1S/C10H10ClF3N2O/c1-15-5-9(17)16-6-2-3-8(11)7(4-6)10(12,13)14/h2-4,15H,5H2,1H3,(H,16,17)
InChIKey
SNNBVGRDRGGJFH-UHFFFAOYSA-N
Compound name
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(methylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

266.04337 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.05065 152.7
[M+Na]+ 289.03259 161.3
[M-H]- 265.03609 152.7
[M+NH4]+ 284.07719 169.8
[M+K]+ 305.00653 156.5
[M+H-H2O]+ 249.04063 145.0
[M+HCOO]- 311.04157 169.1
[M+CH3COO]- 325.05722 199.4
[M+Na-2H]- 287.01804 156.7
[M]+ 266.04282 150.2
[M]- 266.04392 150.2
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.