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REL-(1R,2S,4S,5S)-4-ACETOXYMETHYL-1-ACETYLAMINO-1-METHYLOCTAHYDRO-2-INDENYLMETHYL-ACETATE

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REL-(1R,2S,4S,5S)-4-ACETOXYMETHYL-1-ACETYLAMINO-1-METHYLOCTAHYDRO-2-INDENYLMETHYL-ACETATE
SpectraBase Compound ID CFIiA8qUT0J
InChI InChI=1S/2C18H29NO5/c2*1-12(20)19-17(4)15(10-23-13(2)21)9-18(11-24-14(3)22)8-6-5-7-16(17)18/h2*15-16H,5-11H2,1-4H3,(H,19,20)/t2*15-,16-,17+,18+/m11/s1
InChIKey AAUJNGONROVBIW-IIJSIZSWSA-N
Mol Weight 678.86 g/mol
Molecular Formula C36H58N2O10
Exact Mass 678.409146 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6YnTxExsHFR
Name REL-(1R,2S,4S,5S)-4-ACETOXYMETHYL-1-ACETYLAMINO-1-METHYLOCTAHYDRO-2-INDENYLMETHYL-ACETATE
Compound Number 52
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H58N2O10
InChI InChI=1S/2C18H29NO5/c2*1-12(20)19-17(4)15(10-23-13(2)21)9-18(11-24-14(3)22)8-6-5-7-16(17)18/h2*15-16H,5-11H2,1-4H3,(H,19,20)/t2*15-,16-,17+,18+/m11/s1
InChIKey AAUJNGONROVBIW-IIJSIZSWSA-N
Literature Reference Author S.E.DENMARK,L.GOMEZ
Literature Reference Citation J.ORG.CHEM.,68,8015(2003)
Literature Reference DOI 10.1021/jo034853w
Molecular Weight 678.864 g/mol
Solvent CDCl3
Source File Reference UWVN20772