John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=BIRoQQ0StoO SpectraBase Spectrum ID=2UWmMFLq6Gs

(accessed ).
19-ACETOXY-3-ALPHA-HYDROXY-SPONGIA-13(16),14-DIEN-2-ONE
SpectraBase Compound ID BIRoQQ0StoO
InChI InChI=1S/C22H30O5/c1-13(23)27-12-22(4)18-7-8-20(2)15-11-26-10-14(15)5-6-17(20)21(18,3)9-16(24)19(22)25/h10-11,17-19,25H,5-9,12H2,1-4H3/t17-,18+,19+,20-,21+,22+/m0/s1
InChIKey RRPXPWIUNPSBIL-SPZHGEQOSA-N
Mol Weight 374.48 g/mol
Molecular Formula C22H30O5
Exact Mass 374.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2UWmMFLq6Gs
Name 19-ACETOXY-3-ALPHA-HYDROXY-SPONGIA-13(16),14-DIEN-2-ONE
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30O5
InChI InChI=1S/C22H30O5/c1-13(23)27-12-22(4)18-7-8-20(2)15-11-26-10-14(15)5-6-17(20)21(18,3)9-16(24)19(22)25/h10-11,17-19,25H,5-9,12H2,1-4H3/t17-,18+,19+,20-,21+,22+/m0/s1
InChIKey RRPXPWIUNPSBIL-SPZHGEQOSA-N
Literature Reference Author S.HIRSCH,Y.KASHMAN
Literature Reference Citation J.NAT.PROD.,51,1243(1988)
Literature Reference DOI 10.1021/np50060a032
Molecular Weight 374.477 g/mol
Solvent CDCl3
Source File Reference UWED17725
SpectraBase Batch ID 6V5zEJkFnVy