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3,7-Bis(aza-18-crown-6)-1,5-azulenequinone
SpectraBase Compound ID D4FTqbts0oX
InChI InChI=1S/C34H52N2O12/c37-30-25-29(35-1-5-39-9-13-43-17-21-47-22-18-44-14-10-40-6-2-35)26-32-31(27-30)33(28-34(32)38)36-3-7-41-11-15-45-19-23-48-24-20-46-16-12-42-8-4-36/h25-28H,1-24H2
InChIKey URZKTYKCKRRWIP-UHFFFAOYSA-N
Mol Weight 680.8 g/mol
Molecular Formula C34H52N2O12
Exact Mass 680.352025 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BF54422Nvnt
Name 3,7-Bis(aza-18-crown-6)-1,5-azulenequinone
Alternate Name(s) 3,7-Bis(aza-18-crown-6)-1,7-azulenequinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H52N2O12
InChI InChI=1S/C34H52N2O12/c37-30-25-29(35-1-5-39-9-13-43-17-21-47-22-18-44-14-10-40-6-2-35)26-32-31(27-30)33(28-34(32)38)36-3-7-41-11-15-45-19-23-48-24-20-46-16-12-42-8-4-36/h25-28H,1-24H2
InChIKey URZKTYKCKRRWIP-UHFFFAOYSA-N
Molecular Weight 680.792 g/mol
SMILES C=12C(=CC(C2=CC(N2CCOCCOCCOCCOCCOCC2)=CC(C1)=O)=O)N1CCOCCOCCOCCOCCOCC1
SPLASH splash10-001i-0000109000-15f66f9c23a2a598c687
Source of Spectrum H1-54-440-5
Wiley ID 1564344