PubChemLite - 64022-61-3 (C44H78N4O8)

Structural Information

Molecular Formula

SMILES

CC1(CC(CC(N1)(C)C)OC(=O)CC(C(CC(=O)OC2CC(NC(C2)(C)C)(C)C)C(=O)OC3CC(NC(C3)(C)C)(C)C)C(=O)OC4CC(NC(C4)(C)C)(C)C)C

InChI

InChI=1S/C44H78N4O8/c1-37(2)19-27(20-38(3,4)45-37)53-33(49)17-31(35(51)55-29-23-41(9,10)47-42(11,12)24-29)32(36(52)56-30-25-43(13,14)48-44(15,16)26-30)18-34(50)54-28-21-39(5,6)46-40(7,8)22-28/h27-32,45-48H,17-26H2,1-16H3

InChIKey

NZNAAUDJKMURFU-UHFFFAOYSA-N

Compound name

tetrakis(2,2,6,6-tetramethylpiperidin-4-yl) butane-1,2,3,4-tetracarboxylate

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]+	791.58928	237.6
[M+Na]+	813.57122	242.2
[M-H]-	789.57472	234.4
[M+NH4]+	808.61582	237.6
[M+K]+	829.54516	216.6
[M+H-H2O]+	773.57926	250.6
[M+HCOO]-	835.58020	239.6
[M+CH3COO]-	849.59585	287.1
[M+Na-2H]-	811.55667	257.5
[M]+	790.58145	248.8
[M]-	790.58255	248.8

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

791.58928

237.6

[M+Na]+

813.57122

242.2

[M-H]-

789.57472

234.4

[M+NH4]+

808.61582

237.6

[M+K]+

829.54516

216.6

[M+H-H2O]+

773.57926

250.6

[M+HCOO]-

835.58020

239.6

[M+CH3COO]-

849.59585

287.1

[M+Na-2H]-

811.55667

257.5

[M]+

790.58145

248.8

[M]-

790.58255

248.8

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

64022-61-3

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe