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(1-R,7-E,11-Z)-(-)-VERTICILLA-4-(20),7,11-TRIENE
SpectraBase Compound ID 3ND5gW7EF9A
InChI InChI=1S/C20H32/c1-15-7-6-8-16(2)10-14-19-17(3)11-13-18(12-9-15)20(19,4)5/h8,18H,1,6-7,9-14H2,2-5H3/b16-8+/t18-/m1/s1
InChIKey SNPPNYAGNBWZCL-XSZFBFBBSA-N
Mol Weight 272.5 g/mol
Molecular Formula C20H32
Exact Mass 272.250401 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HUhMMQb3EBd
Name (1-R,7-E,11-Z)-(-)-VERTICILLA-4-(20),7,11-TRIENE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32
InChI InChI=1S/C20H32/c1-15-7-6-8-16(2)10-14-19-17(3)11-13-18(12-9-15)20(19,4)5/h8,18H,1,6-7,9-14H2,2-5H3/b16-8+/t18-/m1/s1
InChIKey SNPPNYAGNBWZCL-XSZFBFBBSA-N
Literature Reference Author J.D.HERNANDEZ-HERNANDEZ,L.U.ROMAN-MARIN,C.M.CERDA-GARCIA-ROJ AS,P.JOSEPH-NATHAN
Literature Reference Citation J.NAT.PROD.,68,1598(2005)
Literature Reference DOI 10.1021/np050323e
Molecular Weight 272.474 g/mol
Solvent CDCl3
Source File Reference UWMZ13060