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5,8-dihydroxy-2-(1-hydroxy-4-methyl-3-pentenyl)-1,4-naphthoquinone, 1-isovalerate
SpectraBase Compound ID GEoWKnNcxHc
InChI InChI=1S/C21H24O6/c1-11(2)5-8-17(27-18(25)9-12(3)4)13-10-16(24)19-14(22)6-7-15(23)20(19)21(13)26/h5-7,10,12,17,22-23H,8-9H2,1-4H3
InChIKey UTOUNDHZJFIVPK-UHFFFAOYSA-N
Mol Weight 372.42 g/mol
Molecular Formula C21H24O6
Exact Mass 372.157288 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jjho0gSkX9M
Name 5,8-DIHYDROXY-2-(1-HYDROXY-4-METHYL-3-PENTENYL)-1,4-NAPHTHOQUINONE,1-ISOVALERATE
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24O6
InChI InChI=1S/C21H24O6/c1-11(2)5-8-17(27-18(25)9-12(3)4)13-10-16(24)19-14(22)6-7-15(23)20(19)21(13)26/h5-7,10,12,17,22-23H,8-9H2,1-4H3
InChIKey UTOUNDHZJFIVPK-UHFFFAOYSA-N
Molecular Weight 372.42
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms ISOVALERYLSHIKONIN SHIKONIN, ISOVALERYL-, 1,4-NAPHTHOQUINONE, 5,8-DIHYDROXY-2-/1-HYDROXY-4-METHYL-3-PENTENYL/-, 1-ISOVALERATE