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3-Bromo-2-deshydroxy-2-oxo-atractyligenin

View entire compound with spectra: 2 NMR

3-Bromo-2-deshydroxy-2-oxo-atractyligenin
SpectraBase Compound ID Jo1Rh40ATGD
InChI InChI=1S/C20H27BrO4/c1-10-11-4-5-14-19(2)9-13(22)16(21)15(18(24)25-3)12(19)6-7-20(14,8-11)17(10)23/h11-12,14-17,23H,1,4-9H2,2-3H3
InChIKey HFISFHJKMBQTBR-UHFFFAOYSA-N
Mol Weight 411.34 g/mol
Molecular Formula C20H27BrO4
Exact Mass 410.109272 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HMuo49vZI24
Name 3-Bromo-2-deshydroxy-2-oxo-atractyligenin
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H27BrO4
InChI InChI=1S/C20H27BrO4/c1-10-11-4-5-14-19(2)9-13(22)16(21)15(18(24)25-3)12(19)6-7-20(14,8-11)17(10)23/h11-12,14-17,23H,1,4-9H2,2-3H3
InChIKey HFISFHJKMBQTBR-UHFFFAOYSA-N
Instrument Name Jeol PFT-100
Literature Reference J.R. Hanson, M. Siverns, F. Piozzi, J. Chem. Soc. Perkin I 114 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3