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13,13'-DIDEOXY-OCTAHYDRO-ELAIOPHYLIDENE
SpectraBase Compound ID BngFHOHkBWC
InChI InChI=1S/C42H76O10/c1-11-33-21-23-41(47,51-31(33)9)29(7)37(45)27(5)39-25(3)17-13-15-20-36(44)50-40(26(4)18-14-16-19-35(43)49-39)28(6)38(46)30(8)42(48)24-22-34(12-2)32(10)52-42/h25-34,37-40,45-48H,11-24H2,1-10H3/t25-,26-,27-,28-,29-,30-,31-,32-,33+,34+,37+,38+,39?,40?,41-,42-/m0/s1
InChIKey HHCVOPWIUCXBIR-KMHIWSHNSA-N
Mol Weight 741.1 g/mol
Molecular Formula C42H76O10
Exact Mass 740.543849 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CGUkMd24gdQ
Name 13,13'-DIDEOXY-OCTAHYDRO-ELAIOPHYLIDENE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H76O10
InChI InChI=1S/C42H76O10/c1-11-33-21-23-41(47,51-31(33)9)29(7)37(45)27(5)39-25(3)17-13-15-20-36(44)50-40(26(4)18-14-16-19-35(43)49-39)28(6)38(46)30(8)42(48)24-22-34(12-2)32(10)52-42/h25-34,37-40,45-48H,11-24H2,1-10H3/t25-,26-,27-,28-,29-,30-,31-,32-,33+,34+,37+,38+,39?,40?,41-,42-/m0/s1
InChIKey HHCVOPWIUCXBIR-KMHIWSHNSA-N
Literature Reference Author P.HAMMANN,G.KRETZSCHMAR
Literature Reference Citation Z.NATURFORSCH.,45B,515(1990)
Molecular Weight 741.059 g/mol
Solvent PYRIDINE-D5
Source File Reference UWCS11670