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6-ETHOXYCARBONYL-5-(3,4-DIMETHOXYPHENYL)-7-HYDROXY-3-METHOXY-1A,4A,5,8-TETRAHYDRO-1,4-NAPHTHOQUINONE
SpectraBase Compound ID IfvILqKCTVf
InChI InChI=1S/C22H24O8/c1-5-30-22(26)20-14(24)9-12-13(23)10-17(29-4)21(25)19(12)18(20)11-6-7-15(27-2)16(8-11)28-3/h6-8,10,12,18-19,24H,5,9H2,1-4H3/t12-,18+,19+/m0/s1
InChIKey OSSPQXXIVDFJJM-GESALYCCSA-N
Mol Weight 416.43 g/mol
Molecular Formula C22H24O8
Exact Mass 416.147118 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1ejVik8HQXD
Name 6-ETHOXYCARBONYL-5-(3,4-DIMETHOXYPHENYL)-7-HYDROXY-3-METHOXY-1A,4A,5,8-TETRAHYDRO-1,4-NAPHTHOQUINONE
Compound Number XV
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H24O8
InChI InChI=1S/C22H24O8/c1-5-30-22(26)20-14(24)9-12-13(23)10-17(29-4)21(25)19(12)18(20)11-6-7-15(27-2)16(8-11)28-3/h6-8,10,12,18-19,24H,5,9H2,1-4H3/t12-,18+,19+/m0/s1
InChIKey OSSPQXXIVDFJJM-GESALYCCSA-N
Literature Reference Author I.V.NECHEPURENKO,E.E.SHULTS,G.A.TOLSTIKOV
Literature Reference Citation RUSS.J.ORG.CHEM.,39,1436(2003)
Literature Reference DOI 10.1023/B:RUJO.0000010560.88282.d3
Molecular Weight 416.428 g/mol
Solvent CDCl3
Source File Reference UWMZ21482