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METHYL-(TRANS/CIS)-4-[(1R,2S)-2-(1-HYDROXYETHYL)-1-METHYLCYCLOBUTYL]-CYCLOHEXANE-1-CARBOXYLATE
SpectraBase Compound ID 7ffcVnILtQa
InChI InChI=1S/2C15H26O3/c2*1-10(16)13-8-9-15(13,2)12-6-4-11(5-7-12)14(17)18-3/h2*10-13,16H,4-9H2,1-3H3/t10-,11-,12+,13+,15+;10-,11-,12-,13+,15+/m11/s1
InChIKey IGLQQXDCMVSGNI-SDEUQGRHSA-N
Mol Weight 508.74 g/mol
Molecular Formula C30H52O6
Exact Mass 508.376389 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID COqWZZTh3l7
Name METHYL-(TRANS/CIS)-4-[(1R,2S)-2-(1-HYDROXYETHYL)-1-METHYLCYCLOBUTYL]-CYCLOHEXANE-1-CARBOXYLATE
Compound Number 3 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H52O6
InChI InChI=1S/2C15H26O3/c2*1-10(16)13-8-9-15(13,2)12-6-4-11(5-7-12)14(17)18-3/h2*10-13,16H,4-9H2,1-3H3/t10-,11-,12+,13+,15+;10-,11-,12-,13+,15+/m11/s1
InChIKey IGLQQXDCMVSGNI-SDEUQGRHSA-N
Literature Reference Author S.PARES,R.ALIBES,M.FIGUEREDO,J.FONT,T.PARELLA
Literature Reference Citation EUR.J.ORG.CHEM.,2012,1404(2012)
Literature Reference DOI 10.1002/ejoc.201101614
Molecular Weight 508.739 g/mol
Solvent CDCl3
Source File Reference UWLU84697