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EPI-BETA-SANTALYLACETATE;REFERENCE
SpectraBase Compound ID LC3kNGWYRMk
InChI InChI=1S/C17H26O2/c1-12(11-19-14(3)18)6-5-9-17(4)13(2)15-7-8-16(17)10-15/h6,15-16H,2,5,7-11H2,1,3-4H3/b12-6+/t15-,16+,17+/m0/s1
InChIKey RCFGRZLLBGMERD-FBBRUODGSA-N
Mol Weight 262.39 g/mol
Molecular Formula C17H26O2
Exact Mass 262.19328 g/mol
Enantiomer InChIKey RCFGRZLLBGMERD-DQRCMHBESA-N
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum W5-1989-34991-30545
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum UT-1990-1575-0
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent Unknown
  • (+)-Epi-.beta.-santalyl acetate
  • Santalol acetate<(E)-beta->
  • 2-penten-1-ol, 2-methyl-5-(2-methyl-3-methylenebicyclo(2,2,1)hept-2-yl)-acetate, (1S-(1alpha,2alpha(E),4alpha))-
Title Journal or Book Year
13C‐NMR spectra of santalol derivatives: a comparison of DFT‐based calculations and database‐oriented prediction techniques Magnetic Resonance in Chemistry 2009

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