CID 3088058

Brn 4549499

Structural Information

Molecular Formula

C₁₆H₂₄N₂O₅

SMILES

COC1=CC(=CC(=C1OC)OC)OCC(=O)NN2CCCCC2

InChI

InChI=1S/C16H24N2O5/c1-20-13-9-12(10-14(21-2)16(13)22-3)23-11-15(19)17-18-7-5-4-6-8-18/h9-10H,4-8,11H2,1-3H3,(H,17,19)

InChIKey

FKPJZKGKPHSKCU-UHFFFAOYSA-N

Compound name

N-piperidin-1-yl-2-(3,4,5-trimethoxyphenoxy)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 324.16852 Da
Monoisotopic Mass: 2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	325.175796	174.7
[M+Na]+	347.157738	178.7
[M-H]-	323.161244	179.1
[M+NH4]+	342.202343	186.9
[M+K]+	363.131678	177.8
[M+H-H2O]+	307.165780	165.4
[M+HCOO]-	369.166721	194.0
[M+CH3COO]-	383.182371	210.1
[M+Na-2H]-	345.143186	176.2
[M]+	324.16797142	177.0
[M]-	324.16906858	177.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe