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19(4),24(4)-Dibenzyloxy-4,7,13,16,20,23-hexaoxo-1,10-diaza-19(1,2),24(1,2)-dibenzenabicyclo[8.8.6]tetracosaphane-2,9-dione
SpectraBase Compound ID Eg1EXlFYNf7
InChI InChI=1S/C40H44N2O10/c43-39-29-47-21-22-48-30-40(44)42-16-18-46-20-19-45-17-15-41(39)35-25-33(51-27-31-7-3-1-4-8-31)11-13-37(35)49-23-24-50-38-14-12-34(26-36(38)42)52-28-32-9-5-2-6-10-32/h1-14,25-26H,15-24,27-30H2
InChIKey HFMFPNFARQDJKD-UHFFFAOYSA-N
Mol Weight 712.8 g/mol
Molecular Formula C40H44N2O10
Exact Mass 712.299596 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4jRO7G426Me
Name 19(4),24(4)-Dibenzyloxy-4,7,13,16,20,23-hexaoxo-1,10-diaza-19(1,2),24(1,2)-dibenzenabicyclo[8.8.6]tetracosaphane-2,9-dione
Alternate Name(s) 4,15-bis(benzyloxy)-8,11,21,24,29,32-hexaoxa-1,18-diazatetracyclo[16.8.8.0(2,7).0(12,17)]tetratriaconta-2,4,6,12,14,16-hexaene-19,26-dione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H44N2O10
InChI InChI=1S/C40H44N2O10/c43-39-29-47-21-22-48-30-40(44)42-16-18-46-20-19-45-17-15-41(39)35-25-33(51-27-31-7-3-1-4-8-31)11-13-37(35)49-23-24-50-38-14-12-34(26-36(38)42)52-28-32-9-5-2-6-10-32/h1-14,25-26H,15-24,27-30H2
InChIKey HFMFPNFARQDJKD-UHFFFAOYSA-N
Molecular Weight 712.796 g/mol
SMILES c12N3CCOCCOCCN(c4c(OCCOc1ccc(c2)OCc1ccccc1)ccc(c4)OCc1ccccc1)C(COCCOCC3=O)=O
SPLASH splash10-03di-0000002900-ee262d2093ccd3ca878a
Source of Spectrum KC-0-1622-15
Wiley ID 821462