CID 218423

Ketone, 1-methyl-3-piperidyl piperidino

Structural Information

Molecular Formula
C12H22N2O
SMILES
CN1CCCC(C1)C(=O)N2CCCCC2
InChI
InChI=1S/C12H22N2O/c1-13-7-5-6-11(10-13)12(15)14-8-3-2-4-9-14/h11H,2-10H2,1H3
InChIKey
LJZSMGYSNXRFQB-UHFFFAOYSA-N
Compound name
(1-methylpiperidin-3-yl)-piperidin-1-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

210.17322 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.180496 152.6
[M+Na]+ 233.162438 154.8
[M-H]- 209.165944 154.5
[M+NH4]+ 228.207043 167.9
[M+K]+ 249.136378 152.9
[M+H-H2O]+ 193.170480 143.7
[M+HCOO]- 255.171421 165.6
[M+CH3COO]- 269.187071 186.1
[M+Na-2H]- 231.147886 153.6
[M]+ 210.17267142 143.7
[M]- 210.17376858 143.7
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

patents stripe