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object
{15}
_id
:
BrPckURmmbC
spectrumID
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BrPckURmmbC
cost
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1
specType
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262144
xnmrNucleus
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dbLocation
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WRX:288750:1
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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1735074081058
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(-)-13-EPI-2-OXO-KOLAVELOOL;13-EPI-ROSEOSTACHENONE;(5R,8R,9S,10R)-2-OXO-ENT-CLEROD-3,14-DIEN-13-ALPHA-OL
SpectraBase Compound ID 2pTowSawYCr
InChI InChI=1S/C20H32O2/c1-7-18(4,22)10-11-20(6)14(2)8-9-19(5)15(3)12-16(21)13-17(19)20/h7,12,14,17,22H,1,8-11,13H2,2-6H3/t14-,17+,18+,19+,20+/m1/s1
InChIKey KARUSPOBGJZEMI-SSRYDLFMSA-N
Mol Weight 304.5 g/mol
Molecular Formula C20H32O2
Exact Mass 304.24023 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 BrPckURmmbC
Name (-)-13-EPI-2-OXO-KOLAVELOOL;13-EPI-ROSEOSTACHENONE;(5R,8R,9S,10R)-2-OXO-ENT-CLEROD-3,14-DIEN-13-ALPHA-OL
Compound Number 48
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32O2
InChI InChI=1S/C20H32O2/c1-7-18(4,22)10-11-20(6)14(2)8-9-19(5)15(3)12-16(21)13-17(19)20/h7,12,14,17,22H,1,8-11,13H2,2-6H3/t14-,17+,18+,19+,20+/m1/s1
InChIKey KARUSPOBGJZEMI-SSRYDLFMSA-N
Literature Reference Author A.G.PACHECO,P.M.DEOLIVEIRA,D.PILO-VELOSO,A.F.D.C.ALCANTARA
Literature Reference Citation MOLECULES,14,1245(2009)
Literature Reference DOI 10.3390/molecules14031245
Molecular Weight 304.473 g/mol
Sample ID 69413
Solvent CDCl3
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