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3,4-SECO-TRACHYLOBANOIC-ACID

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3,4-SECO-TRACHYLOBANOIC-ACID
SpectraBase Compound ID BoveHboE5Qy
InChI InChI=1S/C20H30O2/c1-12(2)13-5-8-20-10-15-14(19(15,4)11-20)9-16(20)18(13,3)7-6-17(21)22/h13-16H,1,5-11H2,2-4H3,(H,21,22)/t13-,14+,15?,16?,18+,19+,20-/m0/s1
InChIKey LJHQFRXKIKJLBA-QJVRDCTISA-N
Mol Weight 302.46 g/mol
Molecular Formula C20H30O2
Exact Mass 302.22458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7sFVyArqVE
Name 3,4-SECO-TRACHYLOBANOIC-ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30O2
InChI InChI=1S/C20H30O2/c1-12(2)13-5-8-20-10-15-14(19(15,4)11-20)9-16(20)18(13,3)7-6-17(21)22/h13-16H,1,5-11H2,2-4H3,(H,21,22)/t13-,14+,15?,16?,18+,19+,20-/m0/s1
InChIKey LJHQFRXKIKJLBA-QJVRDCTISA-N
Literature Reference Author J.D.MCCHESNEY,A.M.CLARK,E.R.SILVEIRA
Literature Reference Citation J.NAT.PROD.,54,1625(1991)
Literature Reference DOI 10.1021/np50078a021
Molecular Weight 302.457 g/mol
Solvent C6D6
Source File Reference UWED18037