Debug Info

object
{15}
_id
:
HP9IkOcvaau
spectrumID
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HP9IkOcvaau
cost
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1
specType
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262144
xnmrNucleus
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dbLocation
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NCX:20634:2
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) Spectrum
isFullSpectrum
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compound
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1735074081058
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3-nitro-2-(phenylthio)pyridine
SpectraBase Compound ID Aph52esZNeU
InChI InChI=1S/C11H8N2O2S/c14-13(15)10-7-4-8-12-11(10)16-9-5-2-1-3-6-9/h1-8H
InChIKey QBKSNGRLYLQJSE-UHFFFAOYSA-N
Mol Weight 232.26 g/mol
Molecular Formula C11H8N2O2S
Exact Mass 232.030649 g/mol
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13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HP9IkOcvaau
Name 3-NITRO-2-(PHENYLTHIO)PYRIDINE
Source of Sample J. C. Jamoulle, University of Liege, Liege, Belgium
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8N2O2S
InChI InChI=1S/C11H8N2O2S/c14-13(15)10-7-4-8-12-11(10)16-9-5-2-1-3-6-9/h1-8H
InChIKey QBKSNGRLYLQJSE-UHFFFAOYSA-N
Melting Point 106C
Molecular Weight 232.26
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms PYRIDINE, 3-NITRO-2-/PHENYLTHIO/-,
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