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METHYL-[1R-(1-ALPHA,4A-BETA,5-BETA,6-ALPHA,8A-ALPHA)]-DECAHYDRO-6-HYDROXYMETHYL-1,4A-DIMETHYL-5-(4-METHYL-3-OXOPENTYL)-NAPHTHALENE-1-CARBOXYLATE

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METHYL-[1R-(1-ALPHA,4A-BETA,5-BETA,6-ALPHA,8A-ALPHA)]-DECAHYDRO-6-HYDROXYMETHYL-1,4A-DIMETHYL-5-(4-METHYL-3-OXOPENTYL)-NAPHTHALENE-1-CARBOXYLATE
SpectraBase Compound ID JfkKleyErA5
InChI InChI=1S/C21H36O4/c1-14(2)17(23)9-8-16-15(13-22)7-10-18-20(16,3)11-6-12-21(18,4)19(24)25-5/h14-16,18,22H,6-13H2,1-5H3/t15-,16-,18+,20+,21+/m0/s1
InChIKey NEDLPMPESJHNHJ-UAOIFFKFSA-N
Mol Weight 352.5 g/mol
Molecular Formula C21H36O4
Exact Mass 352.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ADMcYvnJsO1
Name METHYL-[1R-(1-ALPHA,4A-BETA,5-BETA,6-ALPHA,8A-ALPHA)]-DECAHYDRO-6-HYDROXYMETHYL-1,4A-DIMETHYL-5-(4-METHYL-3-OXOPENTYL)-NAPHTHALENE-1-CARBOXYLATE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H36O4
InChI InChI=1S/C21H36O4/c1-14(2)17(23)9-8-16-15(13-22)7-10-18-20(16,3)11-6-12-21(18,4)19(24)25-5/h14-16,18,22H,6-13H2,1-5H3/t15-,16-,18+,20+,21+/m0/s1
InChIKey NEDLPMPESJHNHJ-UAOIFFKFSA-N
Literature Reference Author E.HASLINGER,A.HUEFNER
Literature Reference Citation MH.CHEM.,126,1109(1995)
Literature Reference DOI 10.1007/BF00811381
Molecular Weight 352.514 g/mol
Solvent CDCl3
Source File Reference UWGN12