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3PFGWxlfj1J
spectrumID
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3PFGWxlfj1J
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analyticalTechnique
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13C NMR
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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1-HYDROXY-2-(3-METHYLBUT-2-ENYL)-9H-XANTHEN-9-ONE
SpectraBase Compound ID HqBr4uogpGQ
InChI InChI=1S/C18H16O3/c1-11(2)7-8-12-9-10-15-16(17(12)19)18(20)13-5-3-4-6-14(13)21-15/h3-7,9-10,19H,8H2,1-2H3
InChIKey KNTJNFLLXDMCNT-UHFFFAOYSA-N
Mol Weight 280.32 g/mol
Molecular Formula C18H16O3
Exact Mass 280.109944 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3PFGWxlfj1J
Name 1-HYDROXY-2-(3-METHYLBUT-2-ENYL)-9H-XANTHEN-9-ONE
Compound Number 11
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H16O3
InChI InChI=1S/C18H16O3/c1-11(2)7-8-12-9-10-15-16(17(12)19)18(20)13-5-3-4-6-14(13)21-15/h3-7,9-10,19H,8H2,1-2H3
InChIKey KNTJNFLLXDMCNT-UHFFFAOYSA-N
Literature Reference Author R.A.P.CASTANHEIRO,A.M.S.SILVA,N.A.N.CAMPOS,M.S.J.NASCIMENTO, M.M.M.PINTO
Literature Reference Citation PHARMACEUTICALS,2,33(2009)
Literature Reference DOI 10.3390/ph2020033
Molecular Weight 280.323 g/mol
Solvent CDCl3
Source File Reference UWLU78569
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