CID 20598138

N-((1-methyl-3-piperidyl)methyl)propionanilide hydriodide

Structural Information

Molecular Formula
C16H24N2O
SMILES
CCC(=O)N(CC1CCCN(C1)C)C2=CC=CC=C2
InChI
InChI=1S/C16H24N2O/c1-3-16(19)18(15-9-5-4-6-10-15)13-14-8-7-11-17(2)12-14/h4-6,9-10,14H,3,7-8,11-13H2,1-2H3
InChIKey
HSVGQZPNYGFACK-UHFFFAOYSA-N
Compound name
N-[(1-methylpiperidin-3-yl)methyl]-N-phenylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.18887 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.196146 163.9
[M+Na]+ 283.178088 166.8
[M-H]- 259.181594 169.1
[M+NH4]+ 278.222693 179.1
[M+K]+ 299.152028 164.7
[M+H-H2O]+ 243.186130 154.8
[M+HCOO]- 305.187071 182.9
[M+CH3COO]- 319.202721 202.5
[M+Na-2H]- 281.163536 165.7
[M]+ 260.18832142 160.8
[M]- 260.18941858 160.8
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.