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4-CHLORO-BENZOIC-ACID-[(5-NITRO-THIOPHEN-2-YL)-METHYLENE]-HYDRAZIDE
SpectraBase Compound ID 92C7c7BjSax
InChI InChI=1S/C12H8ClN3O3S/c13-9-3-1-8(2-4-9)12(17)15-14-7-10-5-6-11(20-10)16(18)19/h1-7H,(H,15,17)/b14-7+
InChIKey ZSQGVNSLKUHWQX-VGOFMYFVSA-N
Mol Weight 309.73 g/mol
Molecular Formula C12H8ClN3O3S
Exact Mass 308.99749 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fwst5vbqJOV
Name 4-CHLORO-BENZOIC-ACID-[(5-NITRO-THIOPHEN-2-YL)-METHYLENE]-HYDRAZIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H8ClN3O3S
InChI InChI=1S/C12H8ClN3O3S/c13-9-3-1-8(2-4-9)12(17)15-14-7-10-5-6-11(20-10)16(18)19/h1-7H,(H,15,17)/b14-7+
InChIKey ZSQGVNSLKUHWQX-VGOFMYFVSA-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 309.727 g/mol
Solvent DMSO-D6
Source File Reference UWLU30937