CID 3064209

Piperidine, 1-(2-(bis(cyclohexylmethyl)amino)ethyl)-, dihydrochloride

Structural Information

Molecular Formula
C21H40N2
SMILES
C1CCC(CC1)CN(CCN2CCCCC2)CC3CCCCC3
InChI
InChI=1S/C21H40N2/c1-4-10-20(11-5-1)18-23(19-21-12-6-2-7-13-21)17-16-22-14-8-3-9-15-22/h20-21H,1-19H2
InChIKey
ZSIHGWQPNXOFMX-UHFFFAOYSA-N
Compound name
N,N-bis(cyclohexylmethyl)-2-piperidin-1-ylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.31915 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.326426 184.7
[M+Na]+ 343.308368 179.2
[M-H]- 319.311874 189.3
[M+NH4]+ 338.352973 195.8
[M+K]+ 359.282308 176.0
[M+H-H2O]+ 303.316410 173.2
[M+HCOO]- 365.317351 195.0
[M+CH3COO]- 379.333001 213.0
[M+Na-2H]- 341.293816 181.7
[M]+ 320.31860142 171.4
[M]- 320.31969858 171.4
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.