Debug Info

object
{15}
_id
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7YyB0FeQmpK
spectrumID
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7YyB0FeQmpK
cost
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specType
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262144
xnmrNucleus
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WRX:43504:1
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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compound
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carduusyne-E ethyl ester
SpectraBase Compound ID 9bapNEzKOh8
InChI InChI=1S/C25H32O3/c1-3-5-6-15-18-21-24(26)22-19-16-13-11-9-7-8-10-12-14-17-20-23-25(27)28-4-2/h7-8,24,26H,3-5,9,11,13,16,19-20,22-23H2,1-2H3/b8-7+
InChIKey FEQWWLBNVBPZBI-BQYQJAHWSA-N
Mol Weight 380.5 g/mol
Molecular Formula C25H32O3
Exact Mass 380.235145 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 7YyB0FeQmpK
Name CARDUUSYNE-E-ETHYLESTER
Compound Number 12
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H32O3
InChI InChI=1S/C25H32O3/c1-3-5-6-15-18-21-24(26)22-19-16-13-11-9-7-8-10-12-14-17-20-23-25(27)28-4-2/h7-8,24,26H,3-5,9,11,13,16,19-20,22-23H2,1-2H3/b8-7+
InChIKey FEQWWLBNVBPZBI-BQYQJAHWSA-N
Literature Reference Author R.ABARROW,R.J.CAPON
Literature Reference Citation AUSTR.J.CHEM.,47,1901(1994)
Literature Reference DOI 10.1071/ch9941901
Molecular Weight 380.527 g/mol
Solvent CDCl3
Source File Reference UWVP4110
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