CID 3040987

1-(2-(2-(6,6-dimethyl-2-norpinanyl)ethoxy)ethyl)-2-pipecoline hydrochloride

Structural Information

Molecular Formula
C19H35NO
SMILES
CC1CCCCN1CCOCCC2CCC3CC2C3(C)C
InChI
InChI=1S/C19H35NO/c1-15-6-4-5-10-20(15)11-13-21-12-9-16-7-8-17-14-18(16)19(17,2)3/h15-18H,4-14H2,1-3H3
InChIKey
DLIFLKVWPMKZIY-UHFFFAOYSA-N
Compound name
1-[2-[2-(6,6-dimethyl-2-bicyclo[3.1.1]heptanyl)ethoxy]ethyl]-2-methylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

293.27185 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.279126 183.5
[M+Na]+ 316.261068 184.5
[M-H]- 292.264574 182.2
[M+NH4]+ 311.305673 197.3
[M+K]+ 332.235008 183.9
[M+H-H2O]+ 276.269110 171.6
[M+HCOO]- 338.270051 189.7
[M+CH3COO]- 352.285701 212.9
[M+Na-2H]- 314.246516 186.5
[M]+ 293.27130142 192.2
[M]- 293.27239858 192.2
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.