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2-ALPHA,3-ALPHA-DIACETYL-CATIVIC-ACID-METHYLESTER
SpectraBase Compound ID 2RNalwW2Eh1
InChI InChI=1S/C25H40O6/c1-15(13-22(28)29-8)9-11-19-16(2)10-12-21-24(5,6)23(31-18(4)27)20(30-17(3)26)14-25(19,21)7/h10,15,19-21,23H,9,11-14H2,1-8H3/t15-,19-,20+,21?,23+,25+/m0/s1
InChIKey NCOBZPULQYUSBH-NAQKNRCUSA-N
Mol Weight 436.6 g/mol
Molecular Formula C25H40O6
Exact Mass 436.282489 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Au3TB2bO6T4
Name 2-ALPHA,3-ALPHA-DIACETYL-CATIVIC-ACID-METHYLESTER
Compound Number 1B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H40O6
InChI InChI=1S/C25H40O6/c1-15(13-22(28)29-8)9-11-19-16(2)10-12-21-24(5,6)23(31-18(4)27)20(30-17(3)26)14-25(19,21)7/h10,15,19-21,23H,9,11-14H2,1-8H3/t15-,19-,20+,21?,23+,25+/m0/s1
InChIKey NCOBZPULQYUSBH-NAQKNRCUSA-N
Literature Reference Author J.C.GIANELLO,M.J.PESTCHANKER,C.E.TONN,M.GUO,O.S.GIORDANO
Literature Reference Citation PHYTOCHEM.,29,656(1990)
Literature Reference DOI 10.1016/0031-9422(90)85138-6
Molecular Weight 436.589 g/mol
Solvent CDCl3
Source File Reference UWVN29372