CID 202923

Piperidine, 1-(2-((3,4,5-trimethoxybenzyl)oxy)ethyl)-

Structural Information

Molecular Formula
C17H27NO4
SMILES
COC1=CC(=CC(=C1OC)OC)COCCN2CCCCC2
InChI
InChI=1S/C17H27NO4/c1-19-15-11-14(12-16(20-2)17(15)21-3)13-22-10-9-18-7-5-4-6-8-18/h11-12H,4-10,13H2,1-3H3
InChIKey
PXHSFECRQXMATJ-UHFFFAOYSA-N
Compound name
1-[2-[(3,4,5-trimethoxyphenyl)methoxy]ethyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.194 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.20128 174.8
[M+Na]+ 332.18322 186.3
[M+NH4]+ 327.22782 181.6
[M+K]+ 348.15716 179.4
[M-H]- 308.18672 177.5
[M+Na-2H]- 330.16867 180.1
[M]+ 309.19345 177.1
[M]- 309.19455 177.1
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.