CID 5597

Troxipide

Structural Information

Molecular Formula

C₁₅H₂₂N₂O₄

SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC2CCCNC2

InChI

InChI=1S/C15H22N2O4/c1-19-12-7-10(8-13(20-2)14(12)21-3)15(18)17-11-5-4-6-16-9-11/h7-8,11,16H,4-6,9H2,1-3H3,(H,17,18)

InChIKey

YSIITVVESCNIPR-UHFFFAOYSA-N

Compound name

3,4,5-trimethoxy-N-piperidin-3-ylbenzamide

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 30
References: 1484
Patents: 294.15796 Da
Monoisotopic Mass: 1.2
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]+	295.16524	169.1
[M+Na]+	317.14718	178.9
[M+NH4]+	312.19178	175.0
[M+K]+	333.12112	174.0
[M-H]-	293.15068	171.1
[M+Na-2H]-	315.13263	173.5
[M]+	294.15741	170.7
[M]-	294.15851	170.7

Literature stripe

literature stripe

Patent stripe

patents stripe