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5-(3-keto-4-methyl-pentyl)-1,4a-dimethyl-6-[(4-methylphenyl)sulfonyloxymethyl]decalin-1-carboxylic acid methyl ester
SpectraBase Compound ID ErFbiit0lBS
InChI InChI=1S/C28H42O6S/c1-19(2)24(29)14-13-23-21(18-34-35(31,32)22-11-8-20(3)9-12-22)10-15-25-27(23,4)16-7-17-28(25,5)26(30)33-6/h8-9,11-12,19,21,23,25H,7,10,13-18H2,1-6H3
InChIKey QLLPGVUNBJQUDO-UHFFFAOYSA-N
Mol Weight 506.7 g/mol
Molecular Formula C28H42O6S
Exact Mass 506.27021 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JrIqw8yp3fG
Name 5-(3-keto-4-methyl-pentyl)-1,4a-dimethyl-6-[(4-methylphenyl)sulfonyloxymethyl]decalin-1-carboxylic acid methyl ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H42O6S
InChI InChI=1S/C28H42O6S/c1-19(2)24(29)14-13-23-21(18-34-35(31,32)22-11-8-20(3)9-12-22)10-15-25-27(23,4)16-7-17-28(25,5)26(30)33-6/h8-9,11-12,19,21,23,25H,7,10,13-18H2,1-6H3
InChIKey QLLPGVUNBJQUDO-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 506.698 g/mol
Source File Reference MHKO16946