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4,4',7,7'-Ethylen-bis-(1-oxa-4,7-diazacyclononane)

View entire compound with spectra: 1 FTIR

4,4',7,7'-Ethylen-bis-(1-oxa-4,7-diazacyclononane)
SpectraBase Compound ID BPIS35SFotK
InChI InChI=1S/C16H32N4O2/c1-2-18-7-8-20-4-3-19(11-15-22-16-12-20)6-5-17(1)9-13-21-14-10-18/h1-16H2
InChIKey SUWKJCHJZGCKIU-UHFFFAOYSA-N
Mol Weight 312.5 g/mol
Molecular Formula C16H32N4O2
Exact Mass 312.252526 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HSErTEVYXEi
Name 4,4',7,7'-Ethylen-bis-(1-oxa-4,7-diazacyclononane)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 312.252526284 u
Formula C16H32N4O2
InChI InChI=1S/C16H32N4O2/c1-2-18-7-8-20-4-3-19(11-15-22-16-12-20)6-5-17(1)9-13-21-14-10-18/h1-16H2
InChIKey SUWKJCHJZGCKIU-UHFFFAOYSA-N
Molecular Weight 312.458 g/mol
SMILES C1N2CCN3CCN(CCN(C1)CCOCC2)CCOCC3
Spectrum/Structure Validation Score (Vapor Phase IR) 0.953625