Debug Info

object
{15}
_id
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A0T2WyHpAKp
spectrumID
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A0T2WyHpAKp
cost
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specType
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262144
xnmrNucleus
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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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compound
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CASSIAPHENONE_B-2-GLUCOSIDE
SpectraBase Compound ID 43QVOuFAUDs
InChI InChI=1S/C21H20O13/c22-6-12-15(25)17(27)18(28)21(34-12)33-11-3-1-2-9(23)14(11)16(26)13-8(20(31)32)4-7(19(29)30)5-10(13)24/h1-5,12,15,17-18,21-25,27-28H,6H2,(H,29,30)(H,31,32)/t12-,15-,17+,18-,21-/m1/s1
InChIKey WGJHPDSSDQSAFA-QUCXHVEGSA-N
Mol Weight 480.38 g/mol
Molecular Formula C21H20O13
Exact Mass 480.090391 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 A0T2WyHpAKp
Name CASSIAPHENONE_B-2-GLUCOSIDE
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H20O13
InChI InChI=1S/C21H20O13/c22-6-12-15(25)17(27)18(28)21(34-12)33-11-3-1-2-9(23)14(11)16(26)13-8(20(31)32)4-7(19(29)30)5-10(13)24/h1-5,12,15,17-18,21-25,27-28H,6H2,(H,29,30)(H,31,32)/t12-,15-,17+,18-,21-/m1/s1
InChIKey WGJHPDSSDQSAFA-QUCXHVEGSA-N
Literature Reference Author C.TERREAUX,Q.WANG,J.IOSET,K.NDJOKO,W.GRIMMINGER,K.HOSTETTMAN N
Literature Reference Citation PLANTA.MED.,68,349(2002)
Literature Reference DOI 10.1055/s-2002-26738
Molecular Weight 480.382 g/mol
Solvent D2O
Source File Reference UIAP1726
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