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MARILZALLENE
SpectraBase Compound ID FwNj4Z9ggzK
InChI InChI=1S/C15H20BrClO2/c1-2-6-13-8-3-4-9-14(17)15(19-13)11-12(18)7-5-10-16/h2-4,6-7,10,12-15,18H,8-9,11H2,1H3/b4-3-,6-2+/t5?,12-,13-,14+,15+/m0/s1
InChIKey UAKMIDIJYGIRKO-LFOVUXSZSA-N
Mol Weight 347.68 g/mol
Molecular Formula C15H20BrClO2
Exact Mass 346.033521 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 342vZVCFchz
Name MARILZALLENE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H20BrClO2
InChI InChI=1S/C15H20BrClO2/c1-2-6-13-8-3-4-9-14(17)15(19-13)11-12(18)7-5-10-16/h2-4,6-7,10,12-15,18H,8-9,11H2,1H3/b4-3-,6-2+/t5?,12-,13-,14+,15+/m0/s1
InChIKey UAKMIDIJYGIRKO-LFOVUXSZSA-N
Literature Reference Author A.GUTIERREZ-CEPEDA,J.J.FERNANDEZ,L.V.GIL,M.LOPEZ-RODRIGUEZ,M .NORTE,M.L.SOUTO
Literature Reference Citation J.NAT.PROD.,74,441(2011)
Literature Reference DOI 10.1021/np100866g
Molecular Weight 347.680 g/mol
Sample ID 37475
Solvent C5D5N