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ETHYL-2-BETA-OCTYL-PERHYDRO-6-AZULENE-CARBOXYLATE
SpectraBase Compound ID KkRpywEpUbB
InChI InChI=1S/C21H38O2/c1-3-5-6-7-8-9-10-17-15-19-13-11-18(21(22)23-4-2)12-14-20(19)16-17/h17-20H,3-16H2,1-2H3/t17-,18-,19?,20?
InChIKey GQXWOYIWWMSWNU-RTWGARKQSA-N
Mol Weight 322.5 g/mol
Molecular Formula C21H38O2
Exact Mass 322.28718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F6FJi7gMtD8
Name ETHYL-2-BETA-OCTYL-PERHYDRO-6-AZULENE-CARBOXYLATE
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H38O2
InChI InChI=1S/C21H38O2/c1-3-5-6-7-8-9-10-17-15-19-13-11-18(21(22)23-4-2)12-14-20(19)16-17/h17-20H,3-16H2,1-2H3/t17-,18-,19?,20?
InChIKey GQXWOYIWWMSWNU-RTWGARKQSA-N
Literature Reference Author Z.HUSSAIN,H.HOPF,S.H.EICHHORN
Literature Reference Citation BEIL.J.ORG.CHEM.,8,403(2012)
Literature Reference DOI 10.3762/bjoc.8.44
Molecular Weight 322.532 g/mol
Solvent CDCl3
Source File Reference UWIR10166