CID 24843828

C 3140

Structural Information

Molecular Formula
C17H25ClN2O
SMILES
CC1CCCC(N1CCC(=O)NC2=C(C=CC=C2Cl)C)C
InChI
InChI=1S/C17H25ClN2O/c1-12-6-4-9-15(18)17(12)19-16(21)10-11-20-13(2)7-5-8-14(20)3/h4,6,9,13-14H,5,7-8,10-11H2,1-3H3,(H,19,21)
InChIKey
UVKVPLHWHTUNAF-UHFFFAOYSA-N
Compound name
N-(2-chloro-6-methylphenyl)-3-(2,6-dimethylpiperidin-1-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

308.16553 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.17281 174.4
[M+Na]+ 331.15475 187.1
[M+NH4]+ 326.19935 182.4
[M+K]+ 347.12869 179.0
[M-H]- 307.15825 178.5
[M+Na-2H]- 329.14020 180.1
[M]+ 308.16498 177.6
[M]- 308.16608 177.6
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.