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2-PHENYLTHIO-3,4,5-TRIHYDROXY-6-HYDROXYMETHYLCYClOHEX-1-ENE
SpectraBase Compound ID HlqVXRa6BZL
InChI InChI=1S/C13H16O4S/c14-7-8-6-10(12(16)13(17)11(8)15)18-9-4-2-1-3-5-9/h1-6,8,11-17H,7H2/t8-,11-,12+,13+/m0/s1
InChIKey FDYYEBDRSNQHQX-HWNAMQAFSA-N
Mol Weight 268.33 g/mol
Molecular Formula C13H16O4S
Exact Mass 268.07693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4jFbYZGZt3l
Name 2-PHENYLTHIO-3,4,5-TRIHYDROXY-6-HYDROXYMETHYLCYClOHEX-1-ENE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16O4S
InChI InChI=1S/C13H16O4S/c14-7-8-6-10(12(16)13(17)11(8)15)18-9-4-2-1-3-5-9/h1-6,8,11-17H,7H2/t8-,11-,12+,13+/m0/s1
InChIKey FDYYEBDRSNQHQX-HWNAMQAFSA-N
Literature Reference Author A.LUBINEAU,I.BILLAULT
Literature Reference Citation CARBOHYDR.RES.,320,49(1999)
Literature Reference DOI 10.1016/S0008-6215(99)00137-8
Molecular Weight 268.328 g/mol
Solvent CD3OD
Source File Reference UWSI9494