CID 45051170

N-(3-chloro-4-methylphenyl)-2,6-dimethyl-1-piperidinecarboxamide

Structural Information

Molecular Formula
C15H21ClN2O
SMILES
CC1CCCC(N1C(=O)NC2=CC(=C(C=C2)C)Cl)C
InChI
InChI=1S/C15H21ClN2O/c1-10-7-8-13(9-14(10)16)17-15(19)18-11(2)5-4-6-12(18)3/h7-9,11-12H,4-6H2,1-3H3,(H,17,19)
InChIKey
NINGMFJMXKIFCB-UHFFFAOYSA-N
Compound name
N-(3-chloro-4-methylphenyl)-2,6-dimethylpiperidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.13425 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.14153 166.5
[M+Na]+ 303.12347 173.4
[M-H]- 279.12697 171.4
[M+NH4]+ 298.16807 182.2
[M+K]+ 319.09741 168.4
[M+H-H2O]+ 263.13151 159.3
[M+HCOO]- 325.13245 180.7
[M+CH3COO]- 339.14810 202.7
[M+Na-2H]- 301.10892 166.8
[M]+ 280.13370 165.1
[M]- 280.13480 165.1
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.