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4-METHOXY-BENZOIC-ACID-[(5-NITRO-THIOPHEN-2-YL)-METHYLENE]-HYDRAZIDE
SpectraBase Compound ID AaVr9ZvAxOs
InChI InChI=1S/C13H11N3O4S/c1-20-10-4-2-9(3-5-10)13(17)15-14-8-11-6-7-12(21-11)16(18)19/h2-8H,1H3,(H,15,17)/b14-8+
InChIKey XBBNVDBSHLJKJC-RIYZIHGNSA-N
Mol Weight 305.31 g/mol
Molecular Formula C13H11N3O4S
Exact Mass 305.047027 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3PHdqcD7Gmq
Name 4-METHOXY-BENZOIC-ACID-[(5-NITRO-THIOPHEN-2-YL)-METHYLENE]-HYDRAZIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H11N3O4S
InChI InChI=1S/C13H11N3O4S/c1-20-10-4-2-9(3-5-10)13(17)15-14-8-11-6-7-12(21-11)16(18)19/h2-8H,1H3,(H,15,17)/b14-8+
InChIKey XBBNVDBSHLJKJC-RIYZIHGNSA-N
Literature Reference Author D.G.RANDO,D.N.SATO,L.SIQUEIRA,A.MALVEZZI,C.Q.F.LEITE,A.T.D.A MARAL,E.I.FERREIRA
Literature Reference Citation BIOORG.MED.CHEM.,10,557(2002)
Literature Reference DOI 10.1016/S0968-0896(01)00313-3
Molecular Weight 305.308 g/mol
Solvent DMSO-D6
Source File Reference UWLU30938