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(11S)-8a-Hydroxy-11-phenylseleno-7aH-eudesm-4-en-12-oic acid, methyl ester

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(11S)-8a-Hydroxy-11-phenylseleno-7aH-eudesm-4-en-12-oic acid, methyl ester
SpectraBase Compound ID FwKEZstG5PJ
InChI InChI=1S/C22H30O3Se/c1-15-9-8-12-21(2)14-19(23)18(13-17(15)21)22(3,20(24)25-4)26-16-10-6-5-7-11-16/h5-7,10-11,18-19,23H,8-9,12-14H2,1-4H3
InChIKey AGYQNVHVYJROQU-UHFFFAOYSA-N
Mol Weight 421.45 g/mol
Molecular Formula C22H30O3Se
Exact Mass 422.136017 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LTXx0sknMl6
Name (11S)-8a-Hydroxy-11-phenylseleno-7aH-eudesm-4-en-12-oic acid, methyl ester
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H30O3Se
InChI InChI=1S/C22H30O3Se/c1-15-9-8-12-21(2)14-19(23)18(13-17(15)21)22(3,20(24)25-4)26-16-10-6-5-7-11-16/h5-7,10-11,18-19,23H,8-9,12-14H2,1-4H3
InChIKey AGYQNVHVYJROQU-UHFFFAOYSA-N
Instrument Name Bruker AM-200
Literature Reference J.A. Marco, M. Carda, Magn. Res. Chem. 25, 1087 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3