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(4'RS,4A'SR,10A'RS)-1-(10A'-ACETOXYMETHYL-7'-METHOXY-2'-METHYL-1',2'-EPOXY-4A',9',10',10A'-TERTAHYDROPHENANTHREN-4-YL)-PROPAN-1-YL-BENZOATE

View entire compound with spectra: 1 NMR

(4'RS,4A'SR,10A'RS)-1-(10A'-ACETOXYMETHYL-7'-METHOXY-2'-METHYL-1',2'-EPOXY-4A',9',10',10A'-TERTAHYDROPHENANTHREN-4-YL)-PROPAN-1-YL-BENZOATE
SpectraBase Compound ID LBjQ36kP9EU
InChI InChI=1S/C29H34O6/c1-5-24(34-26(31)19-9-7-6-8-10-19)23-16-28(3)27(35-28)29(17-33-18(2)30)14-13-20-15-21(32-4)11-12-22(20)25(23)29/h6-12,15,23-25,27H,5,13-14,16-17H2,1-4H3/t23-,24?,25+,27?,28?,29-/m0/s1
InChIKey VGWAXYMOVAQQFK-JGGLXCAPSA-N
Mol Weight 478.6 g/mol
Molecular Formula C29H34O6
Exact Mass 478.235539 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3vorWqG1JMQ
Name (4'RS,4A'SR,10A'RS)-1-(10A'-ACETOXYMETHYL-7'-METHOXY-2'-METHYL-1',2'-EPOXY-4A',9',10',10A'-TERTAHYDROPHENANTHREN-4-YL)-PROPAN-1-YL-BENZOATE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H34O6
InChI InChI=1S/C29H34O6/c1-5-24(34-26(31)19-9-7-6-8-10-19)23-16-28(3)27(35-28)29(17-33-18(2)30)14-13-20-15-21(32-4)11-12-22(20)25(23)29/h6-12,15,23-25,27H,5,13-14,16-17H2,1-4H3/t23-,24?,25+,27?,28?,29-/m0/s1
InChIKey VGWAXYMOVAQQFK-JGGLXCAPSA-N
Literature Reference Author K.A.FAIRWEATHER,L.N.MANDER
Literature Reference Citation ORG.LETTERS,8,3395(2006)
Literature Reference DOI 10.1021/ol061228f
Molecular Weight 478.585 g/mol
Sample ID 60506
Solvent CDCl3