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object
{15}
_id
:
9QkkFPCW0Vs
spectrumID
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9QkkFPCW0Vs
cost
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1
specType
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262144
xnmrNucleus
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dbLocation
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WRX:249763:1
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
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1735074081058
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(-)-(3AS,6R,6AR,8AR,9S,9AS)-DECAHYDRO-9-HYDROXY-6-METHOXY-6,8A-DIMETHYL-3-METHYLENE-CYCLOBUTA-[6,7]-CYCLOOCTA-[1,2-B]-FURAN-2-(3H)-ONE
SpectraBase Compound ID JBcCuCWoBwn
InChI InChI=1S/C16H24O4/c1-9-10-5-8-16(3,19-4)11-6-7-15(11,2)13(17)12(10)20-14(9)18/h10-13,17H,1,5-8H2,2-4H3/t10-,11+,12-,13+,15+,16+/m0/s1
InChIKey XXEBZRFHJOWFBK-KTSCVPDNSA-N
Mol Weight 280.36 g/mol
Molecular Formula C16H24O4
Exact Mass 280.167459 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 9QkkFPCW0Vs
Name (-)-(3AS,6R,6AR,8AR,9S,9AS)-DECAHYDRO-9-HYDROXY-6-METHOXY-6,8A-DIMETHYL-3-METHYLENE-CYCLOBUTA-[6,7]-CYCLOOCTA-[1,2-B]-FURAN-2-(3H)-ONE
Compound Number 9
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H24O4
InChI InChI=1S/C16H24O4/c1-9-10-5-8-16(3,19-4)11-6-7-15(11,2)13(17)12(10)20-14(9)18/h10-13,17H,1,5-8H2,2-4H3/t10-,11+,12-,13+,15+,16+/m0/s1
InChIKey XXEBZRFHJOWFBK-KTSCVPDNSA-N
Literature Reference Author H.NEUKIRCH,N.C.KANEIDER,C.J.WIEDERMANN,A.GUERRIERO,M.D.AMBRO SIO
Literature Reference Citation BIOORG.MED.CHEM.,11,1503(2003)
Literature Reference DOI 10.1016/S0968-0896(02)00553-9
Molecular Weight 280.364 g/mol
Sample ID 29081
Solvent CDCl3
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