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[(2R,4R)-2-(4-METHOXYPHENYL)-1,3-DIOXAN-4-YL]-METHYL-4-METHYLBENZENESULFONATE
SpectraBase Compound ID 3Ui6Jijh5NV
InChI InChI=1S/C19H22O6S/c1-14-3-9-18(10-4-14)26(20,21)24-13-17-11-12-23-19(25-17)15-5-7-16(22-2)8-6-15/h3-10,17,19H,11-13H2,1-2H3/t17-,19-/m1/s1
InChIKey XSKCUSGERFTEHW-IEBWSBKVSA-N
Mol Weight 378.44 g/mol
Molecular Formula C19H22O6S
Exact Mass 378.11371 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BX0ldxp8Pxq
Name [(2R,4R)-2-(4-METHOXYPHENYL)-1,3-DIOXAN-4-YL]-METHYL-4-METHYLBENZENESULFONATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H22O6S
InChI InChI=1S/C19H22O6S/c1-14-3-9-18(10-4-14)26(20,21)24-13-17-11-12-23-19(25-17)15-5-7-16(22-2)8-6-15/h3-10,17,19H,11-13H2,1-2H3/t17-,19-/m1/s1
InChIKey XSKCUSGERFTEHW-IEBWSBKVSA-N
Literature Reference Author T.GUSTAFSSON,M.SCHOU,F.ALMQVIST,J.KIHLBERG
Literature Reference Citation J.ORG.CHEM.,69,8694(2004)
Literature Reference DOI 10.1021/jo049136w
Molecular Weight 378.440 g/mol
Solvent CDCl3
Source File Reference UWVN22959