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N-(3-keto-1,2,4-thiadiazol-5-yl)-3-nitro-benzamide
SpectraBase Compound ID HLqfUXUyScR
InChI InChI=1S/C9H6N4O4S/c14-7(10-9-11-8(15)12-18-9)5-2-1-3-6(4-5)13(16)17/h1-4H,(H2,10,11,12,14,15)
InChIKey HWFGFBDAPKWYEO-UHFFFAOYSA-N
Mol Weight 266.23 g/mol
Molecular Formula C9H6N4O4S
Exact Mass 266.010976 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7uoyGzMDDHg
Name N-(3-keto-1,2,4-thiadiazol-5-yl)-3-nitro-benzamide
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H6N4O4S
InChI InChI=1S/C9H6N4O4S/c14-7(10-9-11-8(15)12-18-9)5-2-1-3-6(4-5)13(16)17/h1-4H,(H2,10,11,12,14,15)
InChIKey HWFGFBDAPKWYEO-UHFFFAOYSA-N
Literature Reference Author N.S.CHO,H.I.SHON,C.PARKANYI
Literature Reference Citation J.HETCYCL.CHEM.,28,1725(1991)
Literature Reference DOI 10.1002/jhet.5570280714
Molecular Weight 266.231 g/mol
Solvent DMSO-D6
Source File Reference UWCP3567