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(1S,2E,4S,6E,8R,11S)-8,11-Epoxy-2,6,12(20)-thunbergatrien-4-ol

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(1S,2E,4S,6E,8R,11S)-8,11-Epoxy-2,6,12(20)-thunbergatrien-4-ol
SpectraBase Compound ID HekeC3nVylx
InChI InChI=1S/C20H32O2/c1-15(2)17-8-7-16(3)18-10-14-20(5,22-18)12-6-11-19(4,21)13-9-17/h6,9,12-13,15,17-18,21H,3,7-8,10-11,14H2,1-2,4-5H3/b12-6+,13-9+
InChIKey SOCRUWBAQPJTHY-IWFZMGPQSA-N
Mol Weight 304.5 g/mol
Molecular Formula C20H32O2
Exact Mass 304.24023 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID j0imoEGQgj
Name (1S,2E,4S,6E,8R,11S)-8,11-Epoxy-2,6,12(20)-thunbergatrien-4-ol
CAS Registry Number 57688-98-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H32O2
InChI InChI=1S/C20H32O2/c1-15(2)17-8-7-16(3)18-10-14-20(5,22-18)12-6-11-19(4,21)13-9-17/h6,9,12-13,15,17-18,21H,3,7-8,10-11,14H2,1-2,4-5H3/b12-6+,13-9+
InChIKey SOCRUWBAQPJTHY-IWFZMGPQSA-N
Instrument Name Varian XL-100
Literature Reference D. Behr, I. Wahlberg, A.J. Aasen, Acta Chem. Scand. B32, 221 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3