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3,6-DIOXO-METHYL-SUMARESINOLATE

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3,6-DIOXO-METHYL-SUMARESINOLATE
SpectraBase Compound ID 2wIks44vdA2
InChI InChI=1S/C31H46O4/c1-26(2)13-15-31(25(34)35-8)16-14-29(6)19(20(31)17-26)9-10-22-28(5)12-11-23(33)27(3,4)24(28)21(32)18-30(22,29)7/h9,20,22,24H,10-18H2,1-8H3/t20-,22?,24-,28+,29+,30+,31-/m0/s1
InChIKey MINDWOKZJPAFFV-JGYSRDLHSA-N
Mol Weight 482.7 g/mol
Molecular Formula C31H46O4
Exact Mass 482.33961 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DTxwVmaKYNC
Name 3,6-DIOXO-METHYL-SUMARESINOLATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H46O4
InChI InChI=1S/C31H46O4/c1-26(2)13-15-31(25(34)35-8)16-14-29(6)19(20(31)17-26)9-10-22-28(5)12-11-23(33)27(3,4)24(28)21(32)18-30(22,29)7/h9,20,22,24H,10-18H2,1-8H3/t20-,22?,24-,28+,29+,30+,31-/m0/s1
InChIKey MINDWOKZJPAFFV-JGYSRDLHSA-N
Literature Reference Author W.R.CHAN,V.SHEPPARD,K.A.MEDFORD,W.F.TINTO,W.F.REYNOLDS,S.MCL EAN
Literature Reference Citation J.NAT.PROD.,55,963(1992)
Literature Reference DOI 10.1021/np50085a020
Molecular Weight 482.704 g/mol
Solvent CDCl3
Source File Reference UWCS5661