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2A-HYDROPEROXY-8-O-ISOBUTYRYL-9-ALPHA-ACETOXY-CUMAMBRIN-B
SpectraBase Compound ID GAjpdKgqIOw
InChI InChI=1S/C21H28O9/c1-8(2)19(23)29-17-14-10(4)20(24)28-16(14)13-9(3)7-12(30-26)15(13)21(6,25)18(17)27-11(5)22/h7-8,12-18,25-26H,4H2,1-3,5-6H3/t12?,13-,14-,15+,16+,17+,18+,21-/m0/s1
InChIKey YQVFFAZLLFZLMF-KISWFXBOSA-N
Mol Weight 424.45 g/mol
Molecular Formula C21H28O9
Exact Mass 424.173332 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CjoUm7S6u1P
Name 2A-HYDROPEROXY-8-O-ISOBUTYRYL-9-ALPHA-ACETOXY-CUMAMBRIN-B
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28O9
InChI InChI=1S/C21H28O9/c1-8(2)19(23)29-17-14-10(4)20(24)28-16(14)13-9(3)7-12(30-26)15(13)21(6,25)18(17)27-11(5)22/h7-8,12-18,25-26H,4H2,1-3,5-6H3/t12?,13-,14-,15+,16+,17+,18+,21-/m0/s1
InChIKey YQVFFAZLLFZLMF-KISWFXBOSA-N
Literature Reference Author V.BULATOVIC,V.VAJS,S.MACURA,N.JURANIC,S.MILOSAVLJEVIC
Literature Reference Citation J.NAT.PROD.,60,1222(1997)
Literature Reference DOI 10.1021/np970185w
Molecular Weight 424.448 g/mol
Solvent CDCl3
Source File Reference UWCS23198