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7-ACETOXY-7,8-DIHYDROBROMOVULONE-I

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7-ACETOXY-7,8-DIHYDROBROMOVULONE-I
SpectraBase Compound ID 9n3ZfGr5n2L
InChI InChI=1S/C23H33BrO6/c1-4-5-6-7-8-12-15-23(28)16-18(24)22(27)21(23)19(30-17(2)25)13-10-9-11-14-20(26)29-3/h8,10,12-13,16,19,21,28H,4-7,9,11,14-15H2,1-3H3/b12-8+,13-10+/t19-,21-,23+/m0/s1
InChIKey KJIAAYSMTGAUFU-TZPPKYLCSA-N
Mol Weight 485.4 g/mol
Molecular Formula C23H33BrO6
Exact Mass 484.146052 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J48DNeUUW5o
Name 7-ACETOXY-7,8-DIHYDROBROMOVULONE-I
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H33BrO6
InChI InChI=1S/C23H33BrO6/c1-4-5-6-7-8-12-15-23(28)16-18(24)22(27)21(23)19(30-17(2)25)13-10-9-11-14-20(26)29-3/h8,10,12-13,16,19,21,28H,4-7,9,11,14-15H2,1-3H3/b12-8+,13-10+/t19-,21-,23+/m0/s1
InChIKey KJIAAYSMTGAUFU-TZPPKYLCSA-N
Literature Reference Author K.WATANABE,M.SEKINE,H.TAKAHASHI,K.IGUCHI
Literature Reference Citation J.NAT.PROD.,64,1421(2001)
Literature Reference DOI 10.1021/np010244c
Molecular Weight 485.415 g/mol
Solvent CDCl3
Source File Reference UWSI2218