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carduusyne-C ethyl ester
SpectraBase Compound ID AL84HtaqJM5
InChI InChI=1S/C26H34O3/c1-4-6-7-16-19-22-25(28-3)23-20-17-14-12-10-8-9-11-13-15-18-21-24-26(27)29-5-2/h8-9,25H,4-6,10,12,14,17,20-21,23-24H2,1-3H3/b9-8+
InChIKey MPDYIUHPIVOTBJ-CMDGGOBGSA-N
Mol Weight 394.6 g/mol
Molecular Formula C26H34O3
Exact Mass 394.250795 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E84yw7fOkxF
Name CARDUUSYNE-C-ETHYLESTER
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H34O3
InChI InChI=1S/C26H34O3/c1-4-6-7-16-19-22-25(28-3)23-20-17-14-12-10-8-9-11-13-15-18-21-24-26(27)29-5-2/h8-9,25H,4-6,10,12,14,17,20-21,23-24H2,1-3H3/b9-8+
InChIKey MPDYIUHPIVOTBJ-CMDGGOBGSA-N
Literature Reference Author R.ABARROW,R.J.CAPON
Literature Reference Citation AUSTR.J.CHEM.,47,1901(1994)
Literature Reference DOI 10.1071/ch9941901
Molecular Weight 394.554 g/mol
Solvent CDCl3
Source File Reference UWVP4113