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MYRCIAPHENONE-B
SpectraBase Compound ID mBCwaR4t0t
InChI InChI=1S/C21H22O13/c1-7(22)15-10(24)4-9(23)5-13(15)33-21-19(30)18(29)17(28)14(34-21)6-32-20(31)8-2-11(25)16(27)12(26)3-8/h2-5,14,17-19,21,23-30H,6H2,1H3/t14-,17-,18+,19-,21-/m0/s1
InChIKey GXHABJFCOYOIBY-QLNFFCRYSA-N
Mol Weight 482.39 g/mol
Molecular Formula C21H22O13
Exact Mass 482.106041 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3Kw20PhdiLl
Name MYRCIAPHENONE-B
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O13
InChI InChI=1S/C21H22O13/c1-7(22)15-10(24)4-9(23)5-13(15)33-21-19(30)18(29)17(28)14(34-21)6-32-20(31)8-2-11(25)16(27)12(26)3-8/h2-5,14,17-19,21,23-30H,6H2,1H3/t14-,17-,18+,19-,21-/m0/s1
InChIKey GXHABJFCOYOIBY-QLNFFCRYSA-N
Literature Reference Author J.SIDANA,D.NEERADI,A.CHOUDHARY,S.SINGH,W.J.FOLEY,I.P.SINGH
Literature Reference Citation J.CHEM.SCI.,125,765(2013)
Literature Reference DOI 10.1007/s12039-013-0440-8
Molecular Weight 482.398 g/mol
Solvent CD3OD
Source File Reference UWBT11367