CID 198919

Jl 1325

Structural Information

Molecular Formula
C18H33N
SMILES
C1CCC(CC1)C2(CCCCC2)CN3CCCCC3
InChI
InChI=1S/C18H33N/c1-4-10-17(11-5-1)18(12-6-2-7-13-18)16-19-14-8-3-9-15-19/h17H,1-16H2
InChIKey
RNEBOKOSQAHBDC-UHFFFAOYSA-N
Compound name
1-[(1-cyclohexylcyclohexyl)methyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.2613 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.26858 171.1
[M+Na]+ 286.25052 168.7
[M-H]- 262.25402 175.5
[M+NH4]+ 281.29512 186.4
[M+K]+ 302.22446 165.2
[M+H-H2O]+ 246.25856 160.8
[M+HCOO]- 308.25950 180.9
[M+CH3COO]- 322.27515 177.8
[M+Na-2H]- 284.23597 170.5
[M]+ 263.26075 156.4
[M]- 263.26185 156.4
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.