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1-(8,12-Dimethyl-1,19-dioxa-5,10,15-triazacyclotricos-10-yl)ethanone

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

1-(8,12-Dimethyl-1,19-dioxa-5,10,15-triazacyclotricos-10-yl)ethanone
SpectraBase Compound ID Ejpjw3SBbKw
InChI InChI=1S/C22H45N3O3/c1-20-8-12-23-10-6-16-27-14-4-5-15-28-17-7-11-24-13-9-21(2)19-25(18-20)22(3)26/h20-21,23-24H,4-19H2,1-3H3
InChIKey ZBDDMXUNAZOTSB-UHFFFAOYSA-N
Mol Weight 399.6 g/mol
Molecular Formula C22H45N3O3
Exact Mass 399.346092 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4GwOmz8SMFM
Name 1-(8,12-Dimethyl-1,19-dioxa-5,10,15-triazacyclotricos-10-yl)ethanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 399.346092318 u
Formula C22H45N3O3
InChI InChI=1S/C22H45N3O3/c1-20-8-12-23-10-6-16-27-14-4-5-15-28-17-7-11-24-13-9-21(2)19-25(18-20)22(3)26/h20-21,23-24H,4-19H2,1-3H3
InChIKey ZBDDMXUNAZOTSB-UHFFFAOYSA-N
Molecular Weight 399.620 g/mol
SMILES C(N1CC(CCNCCCOCCCCOCCCNCCC(C1)C)C)(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.907688