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ENDO-MAJOR-ISOMER
SpectraBase Compound ID BiCVnSIjEwf
InChI InChI=1S/C34H42OP.C5H.Co/c1-24(26-13-5-3-6-14-26)32-21-22-33(25(2)27-15-7-4-8-16-27)36(32,35)34-23-28-17-9-10-18-29(28)30-19-11-12-20-31(30)34;1-2-4-5-3-1;/h3-8,13-16,23-25,28,32-33H,9-12,17-22H2,1-2H3;1H;/t24?,25?,28-,32?,33?,36?;;/m1../s1
InChIKey MBHSMUIUJJCCAB-GJGCGYNKSA-N
Mol Weight 617.7 g/mol
Molecular Formula C39H43CoOP
Exact Mass 617.238347 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cf1XaZolpIx
Name ENDO-MAJOR-ISOMER
Compound Number 20A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H43CoOP
InChI InChI=1S/C34H42OP.C5H.Co/c1-24(26-13-5-3-6-14-26)32-21-22-33(25(2)27-15-7-4-8-16-27)36(32,35)34-23-28-17-9-10-18-29(28)30-19-11-12-20-31(30)34;1-2-4-5-3-1;/h3-8,13-16,23-25,28,32-33H,9-12,17-22H2,1-2H3;1H;/t24?,25?,28-,32?,33?,36?;;/m1../s1
InChIKey MBHSMUIUJJCCAB-GJGCGYNKSA-N
Literature Reference Author F.SLOWINSKI,C.AUBERT,M.MALACRIA
Literature Reference Citation J.ORG.CHEM.,68,378(2003)
Literature Reference DOI 10.1021/jo026212r
Molecular Weight 617.677 g/mol
Solvent C6D6
Source File Reference UWVN25116