Debug Info

object
{15}
_id
:
BetugIKIRQA
spectrumID
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BetugIKIRQA
cost
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1
specType
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262144
xnmrNucleus
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dbLocation
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WRX:127459:1
hasStructureAssignments
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properties
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analyticalTechnique
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13C NMR
analyticalTechniqueLongName
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
isFullSpectrum
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false
spectralOutlier
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false
compound
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1735074081058
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false

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2,4,6-TRIHYDROXY-2-[(4-HYDROXYPHENYL)-METHYL]-3(2H)-BENZOFURANONE;MAESOPSIN
SpectraBase Compound ID DFZFbcz3Nx3
InChI InChI=1S/C15H12O6/c16-9-3-1-8(2-4-9)7-15(20)14(19)13-11(18)5-10(17)6-12(13)21-15/h1-6,16-18,20H,7H2
InChIKey LOFYFDPXORJJEE-UHFFFAOYSA-N
Mol Weight 288.25 g/mol
Molecular Formula C15H12O6
Exact Mass 288.063388 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 BetugIKIRQA
Name 2,4,6-TRIHYDROXY-2-[(4-HYDROXYPHENYL)-METHYL]-3(2H)-BENZOFURANONE;MAESOPSIN
Compound Number 6
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H12O6
InChI InChI=1S/C15H12O6/c16-9-3-1-8(2-4-9)7-15(20)14(19)13-11(18)5-10(17)6-12(13)21-15/h1-6,16-18,20H,7H2
InChIKey LOFYFDPXORJJEE-UHFFFAOYSA-N
Literature Reference Author K.YOSHIKAWA,K.EIKO,N.MIMURA,Y.KONDO,S.ARIHARA
Literature Reference Citation J.NAT.PROD.,61,786(1998)
Literature Reference DOI 10.1021/np9800396
Molecular Weight 288.257 g/mol
Solvent DMSO-D6
Source File Reference UWCP374
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