CID 11695

596-99-6

Structural Information

Molecular Formula
C13H24N2O
SMILES
CC1CC(=O)C(CN1C)(C)N2CCCCC2
InChI
InChI=1S/C13H24N2O/c1-11-9-12(16)13(2,10-14(11)3)15-7-5-4-6-8-15/h11H,4-10H2,1-3H3
InChIKey
HOMBADDIMIXHTI-UHFFFAOYSA-N
Compound name
1,2,5-trimethyl-5-piperidin-1-ylpiperidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.18886 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.196136 155.5
[M+Na]+ 247.178078 160.4
[M-H]- 223.181584 158.3
[M+NH4]+ 242.222683 173.0
[M+K]+ 263.152018 158.2
[M+H-H2O]+ 207.186120 147.6
[M+HCOO]- 269.187061 169.3
[M+CH3COO]- 283.202711 190.7
[M+Na-2H]- 245.163526 156.9
[M]+ 224.18831142 148.9
[M]- 224.18940858 148.9
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.