CID 13706113

N-(3-chlorophenyl)-2-(methylamino)acetamide hydrochloride

Structural Information

Molecular Formula
C9H11ClN2O
SMILES
CNCC(=O)NC1=CC(=CC=C1)Cl
InChI
InChI=1S/C9H11ClN2O/c1-11-6-9(13)12-8-4-2-3-7(10)5-8/h2-5,11H,6H2,1H3,(H,12,13)
InChIKey
LGDBZEAQDWZKIZ-UHFFFAOYSA-N
Compound name
N-(3-chlorophenyl)-2-(methylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.05598 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.063256 141.3
[M+Na]+ 221.045198 148.8
[M-H]- 197.048704 145.0
[M+NH4]+ 216.089803 161.0
[M+K]+ 237.019138 145.1
[M+H-H2O]+ 181.053240 136.0
[M+HCOO]- 243.054181 162.8
[M+CH3COO]- 257.069831 187.3
[M+Na-2H]- 219.030646 147.6
[M]+ 198.05543142 142.2
[M]- 198.05652858 142.2
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.