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4-O-BENZYL-2-O-(4-METHYLPHENYLSULFONYL)-SCYLLO-INOSITOL-1,3,5-ORTHOFORMATE

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4-O-BENZYL-2-O-(4-METHYLPHENYLSULFONYL)-SCYLLO-INOSITOL-1,3,5-ORTHOFORMATE
SpectraBase Compound ID JpIkV6O18yt
InChI InChI=1S/C21H22O8S/c1-12-7-9-14(10-8-12)30(23,24)29-20-17-15(22)16-18(19(20)28-21(26-16)27-17)25-11-13-5-3-2-4-6-13/h2-10,15-22H,11H2,1H3/t15-,16-,17+,18+,19-,20-,21-/m0/s1
InChIKey KXNMQSNQSQYFGC-CZUPSRJTSA-N
Mol Weight 434.46 g/mol
Molecular Formula C21H22O8S
Exact Mass 434.103539 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gr73fJI5n52
Name 4-O-BENZYL-2-O-(4-METHYLPHENYLSULFONYL)-SCYLLO-INOSITOL-1,3,5-ORTHOFORMATE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O8S
InChI InChI=1S/C21H22O8S/c1-12-7-9-14(10-8-12)30(23,24)29-20-17-15(22)16-18(19(20)28-21(26-16)27-17)25-11-13-5-3-2-4-6-13/h2-10,15-22H,11H2,1H3/t15-,16-,17+,18+,19-,20-,21-/m0/s1
InChIKey KXNMQSNQSQYFGC-CZUPSRJTSA-N
Literature Reference Author A.SCAFFIDI,R.V.STICK
Literature Reference Citation AUSTR.J.CHEM.,59,894(2006)
Literature Reference DOI 10.1071/CH06393
Molecular Weight 434.461 g/mol
Sample ID 37703
Solvent Unknown