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5-METHYL-4-(PARA-NITROPHENYL)-1,2,3-THIADIAZOLE

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5-METHYL-4-(PARA-NITROPHENYL)-1,2,3-THIADIAZOLE
SpectraBase Compound ID 5TzcjNYt83P
InChI InChI=1S/C9H7N3O2S/c1-6-9(10-11-15-6)7-3-2-4-8(5-7)12(13)14/h2-5H,1H3
InChIKey SZSBZVOAOVCFLG-UHFFFAOYSA-N
Mol Weight 221.23 g/mol
Molecular Formula C9H7N3O2S
Exact Mass 221.025898 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HLqOU6fSX99
Name 5-METHYL-4-(PARA-NITROPHENYL)-1,2,3-THIADIAZOLE
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H7N3O2S
InChI InChI=1S/C9H7N3O2S/c1-6-9(10-11-15-6)7-3-2-4-8(5-7)12(13)14/h2-5H,1H3
InChIKey SZSBZVOAOVCFLG-UHFFFAOYSA-N
Literature Reference Author G.L'ABBE,A.FREDERIX
Literature Reference Citation J.HETCYCL.CHEM.,27,1415(1990)
Literature Reference DOI 10.1002/jhet.5570270543
Molecular Weight 221.233 g/mol
Solvent CDCl3
Source File Reference UWMZ1038