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12,34-Dioxo-N,N'-diacetyl-1,23-diaza-cyclotetratetracontane
SpectraBase Compound ID I6kp5Uc27TR
InChI InChI=1S/C46H86N2O4/c1-43(49)47-39-31-23-15-7-3-11-19-27-35-45(51)37-29-21-13-5-9-17-25-33-41-48(44(2)50)42-34-26-18-10-6-14-22-30-38-46(52)36-28-20-12-4-8-16-24-32-40-47/h3-42H2,1-2H3
InChIKey QCTXSFDEUKVYBR-UHFFFAOYSA-N
Mol Weight 731.2 g/mol
Molecular Formula C46H86N2O4
Exact Mass 730.658759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57AHWFcqAGW
Name 12,34-Dioxo-N,N'-diacetyl-1,23-diaza-cyclotetratetracontane
Alternate Name(s) 1,23-diacetyl-1,23-diazacyclotetratetracontane-12,34-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C46H86N2O4
InChI InChI=1S/C46H86N2O4/c1-43(49)47-39-31-23-15-7-3-11-19-27-35-45(51)37-29-21-13-5-9-17-25-33-41-48(44(2)50)42-34-26-18-10-6-14-22-30-38-46(52)36-28-20-12-4-8-16-24-32-40-47/h3-42H2,1-2H3
InChIKey QCTXSFDEUKVYBR-UHFFFAOYSA-N
Molecular Weight 731.204 g/mol
SMILES C1C(=O)CCCCCCCCCCN(C(C)=O)CCCCCCCCCCC(=O)CCCCCCCCCCN(C(=O)C)CCCCCCCCC1
SPLASH splash10-000i-0000009000-172c703a3cc240fc7301
Source of Spectrum K-104-3586-12
Wiley ID 1793403