Debug Info

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_id
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ApcvfpZXLSE
spectrumID
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ApcvfpZXLSE
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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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4-[(2-hydroxy-5-nitro-phenyl)amino]-4-keto-but-2-enoic acid
SpectraBase Compound ID AoKs3j9EYQa
InChI InChI=1S/C10H8N2O6/c13-8-2-1-6(12(17)18)5-7(8)11-9(14)3-4-10(15)16/h1-5,13H,(H,11,14)(H,15,16)/b4-3+
InChIKey XSYPPKQCIDTBGR-ONEGZZNKSA-N
Mol Weight 252.18 g/mol
Molecular Formula C10H8N2O6
Exact Mass 252.038236 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 ApcvfpZXLSE
Name 4-[(2-hydroxy-5-nitro-phenyl)amino]-4-keto-but-2-enoic acid
Compound Number 2H
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H8N2O6
InChI InChI=1S/C10H8N2O6/c13-8-2-1-6(12(17)18)5-7(8)11-9(14)3-4-10(15)16/h1-5,13H,(H,11,14)(H,15,16)/b4-3+
InChIKey XSYPPKQCIDTBGR-ONEGZZNKSA-N
Literature Reference Author J.TRUJILLO-FERRARA,R.SANTILLAN,H.I.BELTRAN,N.FARFAN,H.HOEPFL
Literature Reference Citation MAGN.RES.CHEM.,37,682(1999)
Literature Reference DOI 10.1002/(sici)1097-458x(199909)37:9<682::aid-mrc500>3.0.co;2-#
Molecular Weight 252.183 g/mol
Solvent DMSO-D6
Source File Reference UWGE5089
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