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GARLICNIN-L-2;(E)-2,6,7-TRITHIADECA-4,9-DIENE-2-OXIDE
SpectraBase Compound ID 5iHtwWueXtz
InChI InChI=1S/C7H12OS3/c1-3-5-9-10-6-4-7-11(2)8/h3-4,6H,1,5,7H2,2H3/b6-4+
InChIKey FPQGSXSLZNUUFB-GQCTYLIASA-N
Mol Weight 208.35 g/mol
Molecular Formula C7H12OS3
Exact Mass 208.005029 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G7OccHTsMb6
Name GARLICNIN-L-2;(E)-2,6,7-TRITHIADECA-4,9-DIENE-2-OXIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12OS3
InChI InChI=1S/C7H12OS3/c1-3-5-9-10-6-4-7-11(2)8/h3-4,6H,1,5,7H2,2H3/b6-4+
InChIKey FPQGSXSLZNUUFB-GQCTYLIASA-N
Literature Reference Author T.NOHARA,Y.FUJIWARA,T.IKEDA,K.YAMAGUCHI,H.MANABE,K.MURAKAMI, M.ONO,D.NAKANO,J.KIN
Literature Reference Citation CHEM.PHARM.BULL.,62,477(2014)
Literature Reference DOI 10.1248/cpb.c14-00003
Molecular Weight 208.352 g/mol
Solvent CDCl3
Source File Reference UWBT13887