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ABIESPIROSIDE-A
SpectraBase Compound ID 9WAIa2wNP3w
InChI InChI=1S/C21H30O9/c1-9-4-5-12-10(2)6-21(7-11(3)19(26)30-21)29-18(12)17(9)28-20-16(25)15(24)14(23)13(8-22)27-20/h4,7,10,12-18,20,22-25H,5-6,8H2,1-3H3/t10-,12+,13-,14-,15+,16-,17+,18+,20+,21+/m0/s1
InChIKey BCONTSUKLHOJAZ-YJAIIGTNSA-N
Mol Weight 426.46 g/mol
Molecular Formula C21H30O9
Exact Mass 426.188983 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6d2b2EQ2uoR
Name ABIESPIROSIDE-A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O9
InChI InChI=1S/C21H30O9/c1-9-4-5-12-10(2)6-21(7-11(3)19(26)30-21)29-18(12)17(9)28-20-16(25)15(24)14(23)13(8-22)27-20/h4,7,10,12-18,20,22-25H,5-6,8H2,1-3H3/t10-,12+,13-,14-,15+,16-,17+,18+,20+,21+/m0/s1
InChIKey BCONTSUKLHOJAZ-YJAIIGTNSA-N
Literature Reference Author X.W.YANG,S.M.LI,Y.L.LI,J.H.XIA,L.WU,Y.H.SHEN,J.M.TIAN,N.WANG ,Y.LIU,W.D.ZHANG
Literature Reference Citation EUR.J.ORG.CHEM.,2010,6531(2010)
Literature Reference DOI 10.1002/ejoc.201001203
Molecular Weight 426.464 g/mol
Solvent CD3OD
Source File Reference UWLU85692