CID 3039080

N-(1-(3,4-dichlorophenyl)propyl)-4-methyl-1-piperidineacetamide

Structural Information

Molecular Formula
C17H24Cl2N2O
SMILES
CCC(C1=CC(=C(C=C1)Cl)Cl)NC(=O)CN2CCC(CC2)C
InChI
InChI=1S/C17H24Cl2N2O/c1-3-16(13-4-5-14(18)15(19)10-13)20-17(22)11-21-8-6-12(2)7-9-21/h4-5,10,12,16H,3,6-9,11H2,1-2H3,(H,20,22)
InChIKey
BOOYHMUXASJZOE-UHFFFAOYSA-N
Compound name
N-[1-(3,4-dichlorophenyl)propyl]-2-(4-methylpiperidin-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.12656 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.13384 180.5
[M+Na]+ 365.11578 185.5
[M-H]- 341.11928 183.9
[M+NH4]+ 360.16038 193.6
[M+K]+ 381.08972 179.3
[M+H-H2O]+ 325.12382 173.3
[M+HCOO]- 387.12476 188.0
[M+CH3COO]- 401.14041 213.1
[M+Na-2H]- 363.10123 178.6
[M]+ 342.12601 180.2
[M]- 342.12711 180.2
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.