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8-(1,3-DITHIAN-2-YL)-3,7-DIMETHYL-1-(2,6,6-TRIMETHYLCYCLOHEX-1-ENYL)-OCTA-1E,7Z-DIEN-4-YNE-3,6-DIOL
SpectraBase Compound ID EKWMLmiPOC
InChI InChI=1S/C23H34O2S2/c1-17-8-6-11-22(3,4)19(17)9-12-23(5,25)13-10-20(24)18(2)16-21-26-14-7-15-27-21/h9,12,16,20-21,24-25H,6-8,11,14-15H2,1-5H3/b12-9+,18-16+
InChIKey BQNNOKJAUOQMMJ-MLNSLSNSSA-N
Mol Weight 406.6 g/mol
Molecular Formula C23H34O2S2
Exact Mass 406.200023 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6L313hU8aIp
Name 8-(1,3-DITHIAN-2-YL)-3,7-DIMETHYL-1-(2,6,6-TRIMETHYLCYCLOHEX-1-ENYL)-OCTA-1E,7Z-DIEN-4-YNE-3,6-DIOL
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H34O2S2
InChI InChI=1S/C23H34O2S2/c1-17-8-6-11-22(3,4)19(17)9-12-23(5,25)13-10-20(24)18(2)16-21-26-14-7-15-27-21/h9,12,16,20-21,24-25H,6-8,11,14-15H2,1-5H3/b12-9+,18-16+
InChIKey BQNNOKJAUOQMMJ-MLNSLSNSSA-N
Literature Reference Author G.SOLLADIE,V.BERL
Literature Reference Citation BULL.SOC.CHIM.FR.,130,568(1993)
Molecular Weight 406.642 g/mol
Solvent CDCl3
Source File Reference UWPR1433