PubChemLite - 109423-00-9 (C26H46N8O2)

Structural Information

Molecular Formula

SMILES

CC1(CC(CC(N1)(C)C)N2CN3C4C5N(C3=O)CN(CN5C(=O)N4C2)C6CC(NC(C6)(C)C)(C)C)C

InChI

InChI=1S/C26H46N8O2/c1-23(2)9-17(10-24(3,4)27-23)29-13-31-19-20-33(21(31)35)15-30(16-34(20)22(36)32(19)14-29)18-11-25(5,6)28-26(7,8)12-18/h17-20,27-28H,9-16H2,1-8H3

InChIKey

KZURVTKPVNKEKH-UHFFFAOYSA-N

Compound name

3,9-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5,7,9,11-hexazatetracyclo[9.2.1.05,13.07,12]tetradecane-6,14-dione

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]+	503.38164	225.9
[M+Na]+	525.36358	232.2
[M+NH4]+	520.40818	234.3
[M+K]+	541.33752	224.6
[M-H]-	501.36708	224.3
[M+Na-2H]-	523.34903	224.1
[M]+	502.37381	226.4
[M]-	502.37491	226.4

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

503.38164

225.9

[M+Na]+

525.36358

232.2

[M+NH4]+

520.40818

234.3

[M+K]+

541.33752

224.6

[M-H]-

501.36708

224.3

[M+Na-2H]-

523.34903

224.1

[M]+

502.37381

226.4

[M]-

502.37491

226.4

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

109423-00-9

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

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