Debug Info

object
{15}
_id
:
Cv4SSTVikJJ
spectrumID
:
Cv4SSTVikJJ
cost
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1
specType
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262144
xnmrNucleus
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0
dbLocation
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WRX:182673:1
hasStructureAssignments
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true
properties
{12}
analyticalTechnique
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13C NMR
analyticalTechniqueLongName
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
isFullSpectrum
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false
spectralOutlier
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false
compound
{10}
lastUpdated
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1735074081058
isDeprecated
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false

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3-Methylcyclohexanone
SpectraBase Compound ID CpuscPM4GzL
InChI InChI=1S/C7H12O/c1-6-3-2-4-7(8)5-6/h6H,2-5H2,1H3/t6-/m1/s1
InChIKey UJBOOUHRTQVGRU-ZCFIWIBFSA-N
Mol Weight 112.17 g/mol
Molecular Formula C7H12O
Exact Mass 112.088815 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 Cv4SSTVikJJ
Name 3-METHYLCYCLOHEXANONE
Compound Number 10
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12O
InChI InChI=1S/C7H12O/c1-6-3-2-4-7(8)5-6/h6H,2-5H2,1H3/t6-/m1/s1
InChIKey UJBOOUHRTQVGRU-ZCFIWIBFSA-N
Literature Reference Author R.J.ABRAHAM,D.S.RIBEIRO
Literature Reference Citation J.CHEM.SOC.PERKIN-2,302(2001)
Literature Reference DOI 10.1039/b008712m
Molecular Weight 112.172 g/mol
Solvent CDCl3
Source File Reference UWMZ23075
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