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Ethanediylidenediamine-dipropane N,N'-Dioxide

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

Ethanediylidenediamine-dipropane N,N'-Dioxide
SpectraBase Compound ID KnUVdbEEkdq
InChI InChI=1S/C8H16N2O2/c1-3-5-9(11)7-8-10(12)6-4-2/h7-8H,3-6H2,1-2H3/b9-7-,10-8-
InChIKey OAGHZZYBRYJBFG-XOHWUJONSA-N
Mol Weight 172.23 g/mol
Molecular Formula C8H16N2O2
Exact Mass 172.121178 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HtbwScIPPB1
Name (Ethane-diylidene)diamine-dipropane - N,N'-dioxide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 172.121177761 u
Formula C8H16N2O2
InChI InChI=1S/C8H16N2O2/c1-3-5-9(11)7-8-10(12)6-4-2/h7-8H,3-6H2,1-2H3/b9-7-,10-8-
InChIKey OAGHZZYBRYJBFG-XOHWUJONSA-N
Molecular Weight 172.228 g/mol
SMILES C(\[N+](=C\C=[N+]\(CCC)[O-])[O-])CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.951056