CID 107031

Einecs 268-042-4

Structural Information

Molecular Formula
C14H28N2
SMILES
CC1CCCN(C1)CCN2CCCC(C2)C
InChI
InChI=1S/C14H28N2/c1-13-5-3-7-15(11-13)9-10-16-8-4-6-14(2)12-16/h13-14H,3-12H2,1-2H3
InChIKey
YAFHICXFCISWPA-UHFFFAOYSA-N
Compound name
3-methyl-1-[2-(3-methylpiperidin-1-yl)ethyl]piperidine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

224.22525 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.232526 159.4
[M+Na]+ 247.214468 161.6
[M-H]- 223.217974 161.1
[M+NH4]+ 242.259073 174.6
[M+K]+ 263.188408 158.8
[M+H-H2O]+ 207.222510 150.2
[M+HCOO]- 269.223451 172.3
[M+CH3COO]- 283.239101 191.8
[M+Na-2H]- 245.199916 159.7
[M]+ 224.22470142 151.5
[M]- 224.22579858 151.5
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.