Debug Info

object
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_id
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7TVPpiuJmzS
spectrumID
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7TVPpiuJmzS
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specType
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262144
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analyticalTechnique
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13C NMR
analyticalTechniqueLongName
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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compound
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N-(5-NITRO-2-PYRIDYL)-ALPHA-ALANINE
SpectraBase Compound ID FucO6Eyt0HB
InChI InChI=1S/C8H9N3O4/c1-5(8(12)13)10-7-3-2-6(4-9-7)11(14)15/h2-5H,1H3,(H,9,10)(H,12,13)
InChIKey ZQASKPADHUTSCC-UHFFFAOYSA-N
Mol Weight 211.18 g/mol
Molecular Formula C8H9N3O4
Exact Mass 211.059306 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 7TVPpiuJmzS
Name N-(5-NITRO-2-PYRIDYL)-ALPHA-ALANINE
Compound Number 16
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H9N3O4
InChI InChI=1S/C8H9N3O4/c1-5(8(12)13)10-7-3-2-6(4-9-7)11(14)15/h2-5H,1H3,(H,9,10)(H,12,13)
InChIKey ZQASKPADHUTSCC-UHFFFAOYSA-N
Literature Reference Author M.DOISE,D.BLONDEAU,H.SLIWA
Literature Reference Citation HETEROCYCLES,34,2079(1992)
Literature Reference DOI 10.3987/COM-92-6022
Molecular Weight 211.177 g/mol
Solvent DMSO-D6
Source File Reference WANG855
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