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(3,3'-Diacetyl-5,5'-bis[ethoxycarbonyl]-glaucyrone) dimer

View entire compound with spectra: 1 NMR

(3,3'-Diacetyl-5,5'-bis[ethoxycarbonyl]-glaucyrone) dimer
SpectraBase Compound ID JndY0Cyp6ok
InChI InChI=1S/C46H42O20/c1-9-59-39(51)31-17-27(21(5)47)43(55)63-35(31)15-13-25(37-33(41(53)61-11-3)19-29(23(7)49)45(57)65-37)26(38-34(42(54)62-12-4)20-30(24(8)50)46(58)66-38)14-16-36-32(40(52)60-10-2)18-28(22(6)48)44(56)64-36/h13-20,25-26H,9-12H2,1-8H3/b15-13+,16-14+
InChIKey XSCCWDLBMYLJGE-WXUKJITCSA-N
Mol Weight 914.8 g/mol
Molecular Formula C46H42O20
Exact Mass 914.226944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CtrAXI3UsRw
Name (3,3'-Diacetyl-5,5'-bis[ethoxycarbonyl]-glaucyrone) dimer
CAS Registry Number 78075-17-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C46H42O20
InChI InChI=1S/C46H42O20/c1-9-59-39(51)31-17-27(21(5)47)43(55)63-35(31)15-13-25(37-33(41(53)61-11-3)19-29(23(7)49)45(57)65-37)26(38-34(42(54)62-12-4)20-30(24(8)50)46(58)66-38)14-16-36-32(40(52)60-10-2)18-28(22(6)48)44(56)64-36/h13-20,25-26H,9-12H2,1-8H3/b15-13+,16-14+
InChIKey XSCCWDLBMYLJGE-WXUKJITCSA-N
Instrument Name Varian XL-100
Literature Reference S.R. Baker, M.J. Begley, L. Crombie, J. Chem. Soc. Perkin I 190 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3