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2-ALPHA-HYDROXY-9-BETA-O-METHYLBUTANOYL-1(10),4,11(13)-GERMACRATRIEN-6-ALPHA,12-OLIDE
SpectraBase Compound ID FI4iRwyr6A8
InChI InChI=1S/C20H28O5/c1-6-12(3)19(22)24-17-10-16-14(5)20(23)25-18(16)8-11(2)7-15(21)9-13(17)4/h8-9,12,15-18,21H,5-7,10H2,1-4H3/b11-8+,13-9+/t12?,15-,16-,17-,18+/m0/s1
InChIKey SQRYPCTWZQIPKH-YJHOHHJSSA-N
Mol Weight 348.44 g/mol
Molecular Formula C20H28O5
Exact Mass 348.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KbcNQBPY89J
Name 2-ALPHA-HYDROXY-9-BETA-O-METHYLBUTANOYL-1(10),4,11(13)-GERMACRATRIEN-6-ALPHA,12-OLIDE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O5
InChI InChI=1S/C20H28O5/c1-6-12(3)19(22)24-17-10-16-14(5)20(23)25-18(16)8-11(2)7-15(21)9-13(17)4/h8-9,12,15-18,21H,5-7,10H2,1-4H3/b11-8+,13-9+/t12?,15-,16-,17-,18+/m0/s1
InChIKey SQRYPCTWZQIPKH-YJHOHHJSSA-N
Literature Reference Author O.SPRING,R.ZIPPER,S.REEB,B.VOGLER,F.B.D.COSTA
Literature Reference Citation PHYTOCHEM.,57,267(2001)
Literature Reference DOI 10.1016/S0031-9422(01)00019-X
Molecular Weight 348.439 g/mol
Solvent CDCl3