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Acetoxy-acetic acid, 6-ethyl-2,3,4,5,6,7,8,9-octahydro-5-hydroxy-4-cyclopentacycloocten-8-yl ester (3aR-3aa, 4b,5a,6a,8b,9
SpectraBase Compound ID Ko8yupMuOAu
InChI InChI=1S/C24H38O5/c1-7-22(5)13-19(29-20(26)14-28-17(4)25)23(6)15(2)10-12-24(16(3)21(22)27)11-8-9-18(23)24/h9,15-16,19,21,27H,7-8,10-14H2,1-6H3/t15-,16?,19?,21?,22?,23+,24+/m0/s1
InChIKey ZDRBHIQTMVDZFX-WZFCBVRZSA-N
Mol Weight 406.6 g/mol
Molecular Formula C24H38O5
Exact Mass 406.271924 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2YSBjHde7mI
Name Acetoxy-acetic acid, 6-ethyl-2,3,4,5,6,7,8,9-octahydro-5-hydroxy-4-cyclopentacycloocten-8-yl ester (3aR-3aa, 4b,5a,6a,8b,9
CAS Registry Number 76338-26-6
Comments WH-90 AND WM-250
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C24H38O5
InChI InChI=1S/C24H38O5/c1-7-22(5)13-19(29-20(26)14-28-17(4)25)23(6)15(2)10-12-24(16(3)21(22)27)11-8-9-18(23)24/h9,15-16,19,21,27H,7-8,10-14H2,1-6H3/t15-,16?,19?,21?,22?,23+,24+/m0/s1
InChIKey ZDRBHIQTMVDZFX-WZFCBVRZSA-N
Instrument Name Bruker WH-90
Literature Reference G. Schulz, H. Berner, Tetrahedron 40, 905 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3