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acetic acid [(1R,3R,4S,4aS,7aS)-1-acetoxy-3-(acetoxymethyl)-5-keto-7-methyl-3,4,4a,7a-tetrahydro-1H-cyclopenta[d]pyran-4-yl] ester

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acetic acid [(1R,3R,4S,4aS,7aS)-1-acetoxy-3-(acetoxymethyl)-5-keto-7-methyl-3,4,4a,7a-tetrahydro-1H-cyclopenta[d]pyran-4-yl] ester
SpectraBase Compound ID FrcuR6surj5
InChI InChI=1S/C16H20O8/c1-7-5-11(20)14-13(7)16(23-10(4)19)24-12(6-21-8(2)17)15(14)22-9(3)18/h5,12-16H,6H2,1-4H3/t12-,13-,14+,15-,16+/m1/s1
InChIKey XUAQZLXFCPIFSI-LJIZCISZSA-N
Mol Weight 340.33 g/mol
Molecular Formula C16H20O8
Exact Mass 340.115818 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 83lu7vZ60lM
Name acetic acid [(1R,3R,4S,4aS,7aS)-1-acetoxy-3-(acetoxymethyl)-5-keto-7-methyl-3,4,4a,7a-tetrahydro-1H-cyclopenta[d]pyran-4-yl] ester
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H20O8
InChI InChI=1S/C16H20O8/c1-7-5-11(20)14-13(7)16(23-10(4)19)24-12(6-21-8(2)17)15(14)22-9(3)18/h5,12-16H,6H2,1-4H3/t12-,13-,14+,15-,16+/m1/s1
InChIKey XUAQZLXFCPIFSI-LJIZCISZSA-N
Literature Reference Author J.MARCO-CONTELLES,J.RUIZ-CARO
Literature Reference Citation J.ORG.CHEM.,64,8302(1999)
Literature Reference DOI 10.1021/jo991044x
Molecular Weight 340.330 g/mol
Sample ID 41344
Solvent CDCl3