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1-(6-HYDROXY-BENZOTHIAZOLE)-3-(THIOPHELIDENE)-5-(4'-NITROBENZOYL)-FORMAZAN

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1-(6-HYDROXY-BENZOTHIAZOLE)-3-(THIOPHELIDENE)-5-(4'-NITROBENZOYL)-FORMAZAN
SpectraBase Compound ID KJdDyRRYQ2G
InChI InChI=1S/C19H12N6O4S2/c26-13-7-8-14-16(10-13)31-19(20-14)24-22-17(15-2-1-9-30-15)21-23-18(27)11-3-5-12(6-4-11)25(28)29/h1-10,26H,(H,23,27)/b21-17+,24-22+
InChIKey LWGJUVSOEJIRLR-WDMDIEEGSA-N
Mol Weight 452.46 g/mol
Molecular Formula C19H12N6O4S2
Exact Mass 452.036145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9lY6rt4hS2n
Name 1-(6-HYDROXY-BENZOTHIAZOLE)-3-(THIOPHELIDENE)-5-(4'-NITROBENZOYL)-FORMAZAN
Compound Number 5I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H12N6O4S2
InChI InChI=1S/C19H12N6O4S2/c26-13-7-8-14-16(10-13)31-19(20-14)24-22-17(15-2-1-9-30-15)21-23-18(27)11-3-5-12(6-4-11)25(28)29/h1-10,26H,(H,23,27)/b21-17+,24-22+
InChIKey LWGJUVSOEJIRLR-WDMDIEEGSA-N
Literature Reference Author K.G.DESAI,K.R.DESAI
Literature Reference Citation J.HETCYCL.CHEM.,43,1083(2006)
Literature Reference DOI 10.1002/jhet.5570430440
Molecular Weight 452.462 g/mol
Sample ID 67705
Solvent CDCl3:DMSO-D6