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1-[2-(5-NITROTHIENYL)-METHYLENE]-4-HYDROXYSEMICARBAZIDE
SpectraBase Compound ID FCd8xVT08S6
InChI InChI=1S/C6H6N4O4S/c11-6(9-12)8-7-3-4-1-2-5(15-4)10(13)14/h1-3,12H,(H2,8,9,11)/b7-3+
InChIKey CLNYXVWWWCIZLF-XVNBXDOJSA-N
Mol Weight 230.2 g/mol
Molecular Formula C6H6N4O4S
Exact Mass 230.010976 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HjyvnynvotD
Name 1-[2-(5-NITROTHIENYL)-METHYLENE]-4-HYDROXYSEMICARBAZIDE
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H5N4O4S
InChI InChI=1S/C6H6N4O4S/c11-6(9-12)8-7-3-4-1-2-5(15-4)10(13)14/h1-3,12H,(H2,8,9,11)/b7-3+
InChIKey CLNYXVWWWCIZLF-XVNBXDOJSA-N
Literature Reference Author S.REN,R.WANG,K.KOMATSU,P.BONAZ-KRAUSE,Y.ZYRIANOV,C.E.M.KENNA ,C.CSIPKE,Z.A.TOKES,
Literature Reference Citation J.MED.CHEM.,45,410(2002)
Literature Reference DOI 10.1021/jm010252q
Molecular Weight 229.190 g/mol
Sample ID 64215
Solvent Unknown