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(2E)-2-[2-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]butane-1,4-diol

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(2E)-2-[2-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]butane-1,4-diol
SpectraBase Compound ID KCAHgDPtCiK
InChI InChI=1S/C20H34O2/c1-15-6-9-18-19(2,3)11-5-12-20(18,4)17(15)8-7-16(14-22)10-13-21/h7,17-18,21-22H,1,5-6,8-14H2,2-4H3/b16-7+/t17-,18-,20+/m0/s1
InChIKey DDVAZDCKVCUKBI-OQONWLFBSA-N
Mol Weight 306.5 g/mol
Molecular Formula C20H34O2
Exact Mass 306.25588 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GAnkfbsElAT
Name (2E)-2-[2-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]butane-1,4-diol
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H34O2
InChI InChI=1S/C20H34O2/c1-15-6-9-18-19(2,3)11-5-12-20(18,4)17(15)8-7-16(14-22)10-13-21/h7,17-18,21-22H,1,5-6,8-14H2,2-4H3/b16-7+/t17-,18-,20+/m0/s1
InChIKey DDVAZDCKVCUKBI-OQONWLFBSA-N
Literature Reference Author B.N.ZHOU,N.J.BAJ,T.E.GLASS,S.MALONE,M.C.M.WERKHOVEN,F.VANTRO ON,J.H.WISSE,D.G.I.K
Literature Reference Citation J.NAT.PROD.,60,1287(1997)
Literature Reference DOI 10.1021/np970233c
Molecular Weight 306.489 g/mol
Solvent CDCl3
Source File Reference UWRU331