Debug Info

object
{15}
_id
:
7y4PMCLQv80
spectrumID
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7y4PMCLQv80
cost
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1
specType
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262144
xnmrNucleus
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dbLocation
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WRX:301150:1
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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spectralOutlier
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compound
{10}
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1735074081058
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false

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CREOSIDE-V
SpectraBase Compound ID jQSMLUZcdD
InChI InChI=1S/C21H38O10/c1-11(2)5-4-6-12(3)7-8-28-21-19(27)17(25)16(24)14(31-21)10-30-20-18(26)15(23)13(22)9-29-20/h5,12-27H,4,6-10H2,1-3H3/t12-,13-,14-,15-,16-,17+,18+,19-,20-,21-/m0/s1
InChIKey DNFPDMPLVACOKC-ISKWUEMLSA-N
Mol Weight 450.5 g/mol
Molecular Formula C21H38O10
Exact Mass 450.246497 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 7y4PMCLQv80
Name CREOSIDE-V
Compound Number 5
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H38O10
InChI InChI=1S/C21H38O10/c1-11(2)5-4-6-12(3)7-8-28-21-19(27)17(25)16(24)14(31-21)10-30-20-18(26)15(23)13(22)9-29-20/h5,12-27H,4,6-10H2,1-3H3/t12-,13-,14-,15-,16-,17+,18+,19-,20-,21-/m0/s1
InChIKey DNFPDMPLVACOKC-ISKWUEMLSA-N
Literature Reference Author S.NAKAMURA,X.LI,H.MATSUDA,M.YOSHIKAWA
Literature Reference Citation CHEM.PHARM.BULL.,56,536(2008)
Literature Reference DOI 10.1248/cpb.56.536
Molecular Weight 450.527 g/mol
Sample ID 1518
Solvent CD3OD
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