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2-[2-[(1R,2R,4aS)-1,2,5,5-tetramethyl-2,3,4,4a,6,7-hexahydronaphthalen-1-yl]ethyl]-5-furan-3-ylpentan-1-ol
SpectraBase Compound ID Aj1Grdf4tvl
InChI InChI=1S/C25H40O2/c1-19-10-11-22-23(9-6-14-24(22,2)3)25(19,4)15-12-20(17-26)7-5-8-21-13-16-27-18-21/h9,13,16,18-20,22,26H,5-8,10-12,14-15,17H2,1-4H3/t19-,20?,22-,25-/m1/s1
InChIKey BUBLWUFKMSXDDM-MBHHTPPASA-N
Mol Weight 372.6 g/mol
Molecular Formula C25H40O2
Exact Mass 372.302831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KKuY5pL4VsI
Name 2-[2-[(1R,2R,4aS)-1,2,5,5-tetramethyl-2,3,4,4a,6,7-hexahydronaphthalen-1-yl]ethyl]-5-furan-3-ylpentan-1-ol
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H40O2
InChI InChI=1S/C25H40O2/c1-19-10-11-22-23(9-6-14-24(22,2)3)25(19,4)15-12-20(17-26)7-5-8-21-13-16-27-18-21/h9,13,16,18-20,22,26H,5-8,10-12,14-15,17H2,1-4H3/t19-,20?,22-,25-/m1/s1
InChIKey BUBLWUFKMSXDDM-MBHHTPPASA-N
Literature Reference Author G.CARR,M.RASZEK,R.V.SOEST,T.MATAINAHO,M.SHOPIK,C.F.B.HOLMES, R.J.ANDERSEN
Literature Reference Citation J.NAT.PROD.,70,1812(2007)
Literature Reference DOI 10.1021/np0702887
Molecular Weight 372.591 g/mol
Sample ID 31087
Solvent CDCl3