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(3E)-7-amino-4-keto-3-[(4-methoxy-2-sulfo-phenyl)hydrazono]naphthalene-2-sulfonic acid
SpectraBase Compound ID NNuT3ZEATq
InChI InChI=1S/C17H15N3O8S2/c1-28-11-3-5-13(14(8-11)29(22,23)24)19-20-16-15(30(25,26)27)7-9-6-10(18)2-4-12(9)17(16)21/h2-8,19H,18H2,1H3,(H,22,23,24)(H,25,26,27)/b20-16-
InChIKey TWYCBNWVCQHECB-SILNSSARSA-N
Mol Weight 453.44 g/mol
Molecular Formula C17H15N3O8S2
Exact Mass 453.030057 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 82m5L3cPLXt
Name (3E)-7-amino-4-keto-3-[(4-methoxy-2-sulfo-phenyl)hydrazono]naphthalene-2-sulfonic acid
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H15N3O8S2
InChI InChI=1S/C17H15N3O8S2/c1-28-11-3-5-13(14(8-11)29(22,23)24)19-20-16-15(30(25,26)27)7-9-6-10(18)2-4-12(9)17(16)21/h2-8,19H,18H2,1H3,(H,22,23,24)(H,25,26,27)/b20-16-
InChIKey TWYCBNWVCQHECB-SILNSSARSA-N
Literature Reference Author C.SZANTAY,Z.CSEPREGI,P.ARANYOSI,I.RUSZNAK,L.TOEKE,A.VIG
Literature Reference Citation MAGN.RES.CHEM.,35,306(1997)
Literature Reference DOI 10.1002/(sici)1097-458x(199705)35:5<306::aid-omr93>3.3.co;2-e
Molecular Weight 453.441 g/mol
Solvent DMSO-D6
Source File Reference UWCP4519