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GARLICNIN-B3;(2-ALPHA,3-BETA,4-BETA,5-BETA)-2-SULFENIC-ACID-5-ALLYL-3,4-DIMETHYL-TETRAHYDROTHIOPHENE-S-OXIDE
SpectraBase Compound ID DzUhOXaGo6k
InChI InChI=1S/C9H16O2S2/c1-4-5-8-6(2)7(3)9(12-10)13(8)11/h4,6-10H,1,5H2,2-3H3/t6-,7+,8-,9+,13?/m1/s1
InChIKey BWCBRBXZARMWOF-PRAMRESUSA-N
Mol Weight 220.34 g/mol
Molecular Formula C9H16O2S2
Exact Mass 220.059172 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4XV9LKRJpk5
Name GARLICNIN-B3;(2-ALPHA,3-BETA,4-BETA,5-BETA)-2-SULFENIC-ACID-5-ALLYL-3,4-DIMETHYL-TETRAHYDROTHIOPHENE-S-OXIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H16O2S2
InChI InChI=1S/C9H16O2S2/c1-4-5-8-6(2)7(3)9(12-10)13(8)11/h4,6-10H,1,5H2,2-3H3/t6-,7+,8-,9+,13?/m1/s1
InChIKey BWCBRBXZARMWOF-PRAMRESUSA-N
Literature Reference Author T.NOHARA,Y.FUJIWARA,T.IKEDA,K.MURAKAMI,M.ONO,D.NAKANO,J.KINJ O
Literature Reference Citation CHEM.PHARM.BULL.,61,695(2013)
Literature Reference DOI 10.1248/cpb.c13-00082
Molecular Weight 220.345 g/mol
Source File Reference UWIR3944