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4-methoxy-6-[(E)-2-methyl-4-[(1S,6R)-1,2,6-trimethyl-1-cyclohex-2-enyl]but-1-enyl]pyran-2-one
SpectraBase Compound ID H1aP9BKW9j5
InChI InChI=1S/C20H28O3/c1-14(11-18-12-17(22-5)13-19(21)23-18)9-10-20(4)15(2)7-6-8-16(20)3/h7,11-13,16H,6,8-10H2,1-5H3/b14-11+/t16-,20-/m1/s1
InChIKey NCBOYBRBUGFNGR-RRHMOEORSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1xdQn94O3eY
Name 4-methoxy-6-[(E)-2-methyl-4-[(1S,6R)-1,2,6-trimethyl-1-cyclohex-2-enyl]but-1-enyl]pyran-2-one
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-14(11-18-12-17(22-5)13-19(21)23-18)9-10-20(4)15(2)7-6-8-16(20)3/h7,11-13,16H,6,8-10H2,1-5H3/b14-11+/t16-,20-/m1/s1
InChIKey NCBOYBRBUGFNGR-RRHMOEORSA-N
Literature Reference Author K.B.KILLDAY,R.LONGLEY,P.J.MCCARTHY,S.A.POMPONI,A.E.WRIGHT,R. F.NEALE,M.A.SILLS
Literature Reference Citation J.NAT.PROD.,56,500(1993)
Literature Reference DOI 10.1021/np50094a008
Molecular Weight 316.441 g/mol
Solvent CDCl3
Source File Reference UWTS1213