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PTASAPBSZJKBML-XIIJWGSISA-N
SpectraBase Compound ID 4eKSTLmO5fO
InChI InChI=1S/C31H30O10/c1-6-18-7-8-19-20-9-10-21-24(36-5)12-11-22(26(21)27(20)41-31(35)23(19)13-18)28-30(39-17(4)34)29(38-16(3)33)25(40-28)14-37-15(2)32/h7-13,25,28-30H,6,14H2,1-5H3/t25-,28+,29-,30+/m1/s1
InChIKey PTASAPBSZJKBML-XIIJWGSISA-N
Mol Weight 562.57 g/mol
Molecular Formula C31H30O10
Exact Mass 562.183897 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IAfYAuIlSrG
Name PTASAPBSZJKBML-XIIJWGSISA-N
Compound Number 17-BETA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H30O10
InChI InChI=1S/C31H30O10/c1-6-18-7-8-19-20-9-10-21-24(36-5)12-11-22(26(21)27(20)41-31(35)23(19)13-18)28-30(39-17(4)34)29(38-16(3)33)25(40-28)14-37-15(2)32/h7-13,25,28-30H,6,14H2,1-5H3/t25-,28+,29-,30+/m1/s1
InChIKey PTASAPBSZJKBML-XIIJWGSISA-N
Literature Reference Author M.BRAKTA,R.N.FARR,B.CHAGUIR,G.MASSIOT,C.LAVAUD,W.R.ANDERSON, D.SINOU,G.D.DAVES
Literature Reference Citation J.ORG.CHEM.,58,2992(1993)
Literature Reference DOI 10.1021/jo00063a015
Molecular Weight 562.573 g/mol
Solvent CDCl3
Source File Reference UWRU812