CID 77295

Piperidine, 1-(3,4,5-trimethoxybenzoyl)-

Structural Information

Molecular Formula
C15H21NO4
SMILES
COC1=CC(=CC(=C1OC)OC)C(=O)N2CCCCC2
InChI
InChI=1S/C15H21NO4/c1-18-12-9-11(10-13(19-2)14(12)20-3)15(17)16-7-5-4-6-8-16/h9-10H,4-8H2,1-3H3
InChIKey
MDFLEQBDVHQKNX-UHFFFAOYSA-N
Compound name
piperidin-1-yl-(3,4,5-trimethoxyphenyl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

279.14706 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.15434 164.7
[M+Na]+ 302.13628 176.4
[M+NH4]+ 297.18088 171.5
[M+K]+ 318.11022 170.7
[M-H]- 278.13978 167.0
[M+Na-2H]- 300.12173 170.1
[M]+ 279.14651 166.8
[M]- 279.14761 166.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.