PubChemLite - 1,2-ethanediamine, n-(((2-(trimethoxysilyl)ethyl)phenyl)methyl)- (C31H46N2O6)

Structural Information

Molecular Formula

SMILES

CC1(CC(CC(N1)(C)C)OC(=O)C2(CC(=O)C3(CC=CC=C3)C(=O)C2)C(=O)OC4CC(NC(C4)(C)C)(C)C)C

InChI

InChI=1S/C31H46N2O6/c1-26(2)14-20(15-27(3,4)32-26)38-24(36)31(18-22(34)30(23(35)19-31)12-10-9-11-13-30)25(37)39-21-16-28(5,6)33-29(7,8)17-21/h9-12,20-21,32-33H,13-19H2,1-8H3

InChIKey

IIZYNJMWYJKDJN-UHFFFAOYSA-N

Compound name

bis(2,2,6,6-tetramethylpiperidin-4-yl) 1,5-dioxospiro[5.5]undeca-8,10-diene-3,3-dicarboxylate

Related CIDs

2D Structure

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]+	543.34288	222.0
[M+Na]+	565.32482	225.8
[M-H]-	541.32832	226.2
[M+NH4]+	560.36942	234.5
[M+K]+	581.29876	224.2
[M+H-H2O]+	525.33286	213.9
[M+HCOO]-	587.33380	223.2
[M+CH3COO]-	601.34945	244.8
[M+Na-2H]-	563.31027	220.2
[M]+	542.33505	216.9
[M]-	542.33615	216.9

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

543.34288

222.0

[M+Na]+

565.32482

225.8

[M-H]-

541.32832

226.2

[M+NH4]+

560.36942

234.5

[M+K]+

581.29876

224.2

[M+H-H2O]+

525.33286

213.9

[M+HCOO]-

587.33380

223.2

[M+CH3COO]-

601.34945

244.8

[M+Na-2H]-

563.31027

220.2

[M]+

542.33505

216.9

[M]-

542.33615

216.9

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.

1,2-ethanediamine, n-(((2-(trimethoxysilyl)ethyl)phenyl)methyl)-

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe