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BRAZILEIN;6A,7-DIHYDRO-3,6A,10-TRIHYDROXY-BENZ-[B]-INDENO-[1,2-D]-PYRAN-9(6-H)-ONE
SpectraBase Compound ID EDBopeSfSsJ
InChI InChI=1S/C16H12O5/c17-9-1-2-10-14(4-9)21-7-16(20)6-8-3-12(18)13(19)5-11(8)15(10)16/h1-5,17,19-20H,6-7H2/t16-/m1/s1
InChIKey MLWIYODOURBGPI-MRXNPFEDSA-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 LoEFEI7vTjI
Name BRAZILEIN;6A,7-DIHYDRO-3,6A,10-TRIHYDROXY-BENZ-[B]-INDENO-[1,2-D]-PYRAN-9(6-H)-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H12O5
InChI InChI=1S/C16H12O5/c17-9-1-2-10-14(4-9)21-7-16(20)6-8-3-12(18)13(19)5-11(8)15(10)16/h1-5,17,19-20H,6-7H2/t16-/m1/s1
InChIKey MLWIYODOURBGPI-MRXNPFEDSA-N
Literature Reference Author D.S.KIM,N.I.BAEK,S.R.OH,K.Y.JUNG,I.S.LEE,H.K.LEE
Literature Reference Citation PHYTOCHEM.,46,177(1997)
Literature Reference DOI 10.1016/s0031-9422(96)00874-6
Molecular Weight 284.268 g/mol
Sample ID 44823
Solvent DMSO-D6