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3-methylvaleric acid [(1S,6S,7S,7aS)-6-acetoxy-4-[(2-acetoxy-3-methyl-butanoyl)oxymethyl]spiro[6,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-oxirane]-1-yl] ester

View entire compound with spectra: 1 NMR

3-methylvaleric acid [(1S,6S,7S,7aS)-6-acetoxy-4-[(2-acetoxy-3-methyl-butanoyl)oxymethyl]spiro[6,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-oxirane]-1-yl] ester
SpectraBase Compound ID JoSuSqwJvMo
InChI InChI=1S/C25H34O10/c1-7-14(4)8-20(28)35-24-21-18(9-19(33-15(5)26)25(21)12-32-25)17(11-31-24)10-30-23(29)22(13(2)3)34-16(6)27/h9,11,13-14,19,21-22,24H,7-8,10,12H2,1-6H3/t14?,19-,21+,22?,24-,25-/m0/s1
InChIKey XACDKHBZZCTLAX-ZCCMVIEUSA-N
Mol Weight 494.5 g/mol
Molecular Formula C25H34O10
Exact Mass 494.215197 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JZwxoRaCyFx
Name 3-methylvaleric acid [(1S,6S,7S,7aS)-6-acetoxy-4-[(2-acetoxy-3-methyl-butanoyl)oxymethyl]spiro[6,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-oxirane]-1-yl] ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H34O10
InChI InChI=1S/C25H34O10/c1-7-14(4)8-20(28)35-24-21-18(9-19(33-15(5)26)25(21)12-32-25)17(11-31-24)10-30-23(29)22(13(2)3)34-16(6)27/h9,11,13-14,19,21-22,24H,7-8,10,12H2,1-6H3/t14?,19-,21+,22?,24-,25-/m0/s1
InChIKey XACDKHBZZCTLAX-ZCCMVIEUSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 494.539 g/mol
Source File Reference MHKO22473