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(1S,5S,6R,7S,8S)-6,7,8-TRIBENZOYLOXY-9-OXA-2,3-DITHIABICYCLO-[3.3.1]-NONANE

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(1S,5S,6R,7S,8S)-6,7,8-TRIBENZOYLOXY-9-OXA-2,3-DITHIABICYCLO-[3.3.1]-NONANE
SpectraBase Compound ID HAsimxSlKz1
InChI InChI=1S/C27H22O7S2/c28-24(17-10-4-1-5-11-17)32-21-20-16-35-36-27(31-20)23(34-26(30)19-14-8-3-9-15-19)22(21)33-25(29)18-12-6-2-7-13-18/h1-15,20-23,27H,16H2/t20-,21+,22+,23+,27+/m1/s1
InChIKey FDVLSMHMOAAAJR-BXOWXZKISA-N
Mol Weight 522.59 g/mol
Molecular Formula C27H22O7S2
Exact Mass 522.080695 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BDlYFf5S08h
Name (1S,5S,6R,7S,8S)-6,7,8-TRIBENZOYLOXY-9-OXA-2,3-DITHIABICYCLO-[3.3.1]-NONANE
Compound Number 47
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H22O7S2
InChI InChI=1S/C27H22O7S2/c28-24(17-10-4-1-5-11-17)32-21-20-16-35-36-27(31-20)23(34-26(30)19-14-8-3-9-15-19)22(21)33-25(29)18-12-6-2-7-13-18/h1-15,20-23,27H,16H2/t20-,21+,22+,23+,27+/m1/s1
InChIKey FDVLSMHMOAAAJR-BXOWXZKISA-N
Literature Reference Author E.D.GODDARD-BORGER,R.V.STICK
Literature Reference Citation AUSTR.J.CHEM.,58,188(2005)
Literature Reference DOI 10.1071/CH04277
Molecular Weight 522.587 g/mol
Sample ID 28950
Solvent Unknown