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5-BENZYLOXYMETHYL-5,9-DIMETHYL-13-BETA,14-BETA-DIETHOXYCARBONYL-16-ISOPROPYL-TETRACYCLO-[10.2.2.0(1,10).0(4,9)]-HEXADEC-15-ENE
SpectraBase Compound ID J63uIcLXwA9
InChI InChI=1S/C35H50O5/c1-7-39-31(36)29-25-19-28-34(6)17-12-16-33(5,22-38-21-24-13-10-9-11-14-24)27(34)15-18-35(28,20-26(25)23(3)4)30(29)32(37)40-8-2/h9-11,13-14,20,23,25,27-30H,7-8,12,15-19,21-22H2,1-6H3/t25-,27?,28?,29-,30-,33-,34-,35-/m0/s1
InChIKey KNVYELJLVKHJLJ-XCHPWWGFSA-N
Mol Weight 550.8 g/mol
Molecular Formula C35H50O5
Exact Mass 550.365825 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7DmKNXiouBG
Name 5-BENZYLOXYMETHYL-5,9-DIMETHYL-13-BETA,14-BETA-DIETHOXYCARBONYL-16-ISOPROPYL-TETRACYCLO-[10.2.2.0(1,10).0(4,9)]-HEXADEC-15-ENE
Compound Number X
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H50O5
InChI InChI=1S/C35H50O5/c1-7-39-31(36)29-25-19-28-34(6)17-12-16-33(5,22-38-21-24-13-10-9-11-14-24)27(34)15-18-35(28,20-26(25)23(3)4)30(29)32(37)40-8-2/h9-11,13-14,20,23,25,27-30H,7-8,12,15-19,21-22H2,1-6H3/t25-,27?,28?,29-,30-,33-,34-,35-/m0/s1
InChIKey KNVYELJLVKHJLJ-XCHPWWGFSA-N
Literature Reference Author A.G.TOLSTIKOV,N.N.KARPYSHEV,O.V.TOLSTIKOVA,T.B.KHLEBNIKOVA,G .E.SALNIKOV,V.I.MAMA
Literature Reference Citation RUSS.J.ORG.CHEM.,37,1134(2001)
Literature Reference DOI 10.1023/A:1013144431609
Molecular Weight 550.779 g/mol
Solvent CDCl3
Source File Reference UWVN5614