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(3AS,5R,11BS)-5-METHYL-3,3A-DIHYDRO-2H-BENZO-[G]-FURO-[3,2-C]-ISOCHROMENE-2,6,11-(5H,11BH)-TRIONE
SpectraBase Compound ID 9OpwFEInkxa
InChI InChI=1S/C16H12O5/c1-7-12-13(16-10(20-7)6-11(17)21-16)15(19)9-5-3-2-4-8(9)14(12)18/h2-5,7,10,16H,6H2,1H3/t7-,10+,16-/m1/s1
InChIKey CLQWEHDPSOGFQR-GHTXELIDSA-N
Mol Weight 284.27 g/mol
Molecular Formula C16H12O5
Exact Mass 284.068473 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BxJrk40VAeU
Name (3AS,5R,11BS)-5-METHYL-3,3A-DIHYDRO-2H-BENZO-[G]-FURO-[3,2-C]-ISOCHROMENE-2,6,11-(5H,11BH)-TRIONE
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H12O5
InChI InChI=1S/C16H12O5/c1-7-12-13(16-10(20-7)6-11(17)21-16)15(19)9-5-3-2-4-8(9)14(12)18/h2-5,7,10,16H,6H2,1H3/t7-,10+,16-/m1/s1
InChIKey CLQWEHDPSOGFQR-GHTXELIDSA-N
Literature Reference Author R.BARTHOLOMAEUS,J.BACHAMANN,C.MANG,L.O.HAUSTEDT,K.HARMS,U.KO ERT
Literature Reference Citation EUR.J.ORG.CHEM.,2013,180(2013)
Literature Reference DOI 10.1002/ejoc.201201279
Molecular Weight 284.268 g/mol
Solvent CDCl3
Source File Reference UWBT17346