Debug Info

object
{15}
_id
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7gZAZSieXK
spectrumID
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7gZAZSieXK
cost
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1
specType
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262144
xnmrNucleus
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WRX:159333:1
hasStructureAssignments
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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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5-BROMO-5-METHYL-1-PHENYLBARBITURIC-ACID
SpectraBase Compound ID GuSf1KKOFsH
InChI InChI=1S/C11H9BrN2O3/c1-11(12)8(15)13-10(17)14(9(11)16)7-5-3-2-4-6-7/h2-6H,1H3,(H,13,15,17)
InChIKey PXHKHIIWZMHDJK-UHFFFAOYSA-N
Mol Weight 297.11 g/mol
Molecular Formula C11H9BrN2O3
Exact Mass 295.979655 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 7gZAZSieXK
Name 5-BROMO-5-METHYL-1-PHENYLBARBITURIC-ACID
Compound Number 2C
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H9BrN2O3
InChI InChI=1S/C11H9BrN2O3/c1-11(12)8(15)13-10(17)14(9(11)16)7-5-3-2-4-6-7/h2-6H,1H3,(H,13,15,17)
InChIKey PXHKHIIWZMHDJK-UHFFFAOYSA-N
Literature Reference Author M.MEUSEL,A.AMBROZAK,T.K.HECKER,M.GUETSCHOW
Literature Reference Citation J.ORG.CHEM.,68,4684(2003)
Literature Reference DOI 10.1021/jo020761f
Molecular Weight 297.108 g/mol
Solvent CDCl3
Source File Reference UWLU23798
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