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GARLICNIN-L-1;(E)-5-THIAOCTA-6-ENE-4-METHYL-2,5-DIOXIDE
SpectraBase Compound ID Bky2VP9iBxD
InChI InChI=1S/C8H14O2S/c1-4-5-11(10)8(3)6-7(2)9/h4-5,8H,6H2,1-3H3/b5-4+
InChIKey LPSYWDADNSGZDC-SNAWJCMRSA-N
Mol Weight 174.26 g/mol
Molecular Formula C8H14O2S
Exact Mass 174.071451 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KYIuf9v5MRN
Name GARLICNIN-L-1;(E)-5-THIAOCTA-6-ENE-4-METHYL-2,5-DIOXIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H14O2S
InChI InChI=1S/C8H14O2S/c1-4-5-11(10)8(3)6-7(2)9/h4-5,8H,6H2,1-3H3/b5-4+
InChIKey LPSYWDADNSGZDC-SNAWJCMRSA-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 174.258 g/mol
Solvent CDCl3
Source File Reference UWBT13886