CID 3025260

102370-70-7

Structural Information

Molecular Formula
C20H31NO
SMILES
C1CCC(CC1)C(C2=CC=CC=C2)OCCN3CCCCC3
InChI
InChI=1S/C20H31NO/c1-4-10-18(11-5-1)20(19-12-6-2-7-13-19)22-17-16-21-14-8-3-9-15-21/h1,4-5,10-11,19-20H,2-3,6-9,12-17H2
InChIKey
UFXYNOGUHPZYQF-UHFFFAOYSA-N
Compound name
1-[2-[cyclohexyl(phenyl)methoxy]ethyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

301.24057 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.247846 176.7
[M+Na]+ 324.229788 175.1
[M-H]- 300.233294 181.4
[M+NH4]+ 319.274393 188.5
[M+K]+ 340.203728 171.2
[M+H-H2O]+ 284.237830 165.9
[M+HCOO]- 346.238771 189.4
[M+CH3COO]- 360.254421 203.5
[M+Na-2H]- 322.215236 176.4
[M]+ 301.24002142 167.5
[M]- 301.24111858 167.5
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.