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acetic acid [(1S,2R,4aR,8R,8aS)-8-hydroxy-2-isopropyl-4a,8-dimethyl-decalin-1-yl] ester
SpectraBase Compound ID 7TdMaM4FQPI
InChI InChI=1S/C17H30O3/c1-11(2)13-7-10-16(4)8-6-9-17(5,19)15(16)14(13)20-12(3)18/h11,13-15,19H,6-10H2,1-5H3/t13-,14+,15-,16-,17-/m1/s1
InChIKey ZMDXCDMYMRLNKX-ZHCJQAHYSA-N
Mol Weight 282.42 g/mol
Molecular Formula C17H30O3
Exact Mass 282.219495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID OF4wbYjEjU
Name acetic acid [(1S,2R,4aR,8R,8aS)-8-hydroxy-2-isopropyl-4a,8-dimethyl-decalin-1-yl] ester
CAS Registry Number 82731-85-9
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H30O3
InChI InChI=1S/C17H30O3/c1-11(2)13-7-10-16(4)8-6-9-17(5,19)15(16)14(13)20-12(3)18/h11,13-15,19H,6-10H2,1-5H3/t13-,14+,15-,16-,17-/m1/s1
InChIKey ZMDXCDMYMRLNKX-ZHCJQAHYSA-N
Literature Reference Author M.R.BRENNAN,K.L.ERICKSON
Literature Reference Citation J.ORG.CHEM.,47,3917(1982)
Literature Reference DOI 10.1021/jo00141a021
Molecular Weight 282.423 g/mol
Solvent CDCl3
Source File Reference UWCS11255