CID 121067

1-piperidineacetamide, n-(m-chlorobenzyl)-, monohydrochloride

Structural Information

Molecular Formula
C14H19ClN2O
SMILES
C1CCN(CC1)CC(=O)NCC2=CC(=CC=C2)Cl
InChI
InChI=1S/C14H19ClN2O/c15-13-6-4-5-12(9-13)10-16-14(18)11-17-7-2-1-3-8-17/h4-6,9H,1-3,7-8,10-11H2,(H,16,18)
InChIKey
YOAQOTVKAWNBHN-UHFFFAOYSA-N
Compound name
N-[(3-chlorophenyl)methyl]-2-piperidin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.1186 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.12588 161.7
[M+Na]+ 289.10782 166.0
[M-H]- 265.11132 165.5
[M+NH4]+ 284.15242 176.8
[M+K]+ 305.08176 161.1
[M+H-H2O]+ 249.11586 153.7
[M+HCOO]- 311.11680 176.2
[M+CH3COO]- 325.13245 196.8
[M+Na-2H]- 287.09327 164.7
[M]+ 266.11805 158.7
[M]- 266.11915 158.7
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.