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PYRROLO-[2,3-D]-[1,2,3]-THIADIAZOLE-4,6-DICARBOXYLIC-ACID-DIMETHYLESTER
SpectraBase Compound ID LlnxHfMT0c9
InChI InChI=1S/C8H7N3O4S/c1-14-7(12)4-3-11(8(13)15-2)6-5(4)16-10-9-6/h3H,1-2H3
InChIKey NDKXDBLCFLQMGR-UHFFFAOYSA-N
Mol Weight 241.22 g/mol
Molecular Formula C8H7N3O4S
Exact Mass 241.015727 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2NZ15vcYvpV
Name PYRROLO-[2,3-D]-[1,2,3]-THIADIAZOLE-4,6-DICARBOXYLIC-ACID-DIMETHYLESTER
Compound Number 4C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H7N3O4S
InChI InChI=1S/C8H7N3O4S/c1-14-7(12)4-3-11(8(13)15-2)6-5(4)16-10-9-6/h3H,1-2H3
InChIKey NDKXDBLCFLQMGR-UHFFFAOYSA-N
Literature Reference Author P.STANETTY,M.TURNER,M.D.MIHOVILOVIC
Literature Reference Citation MOLECULES,10,367(2005)
Literature Reference DOI 10.3390/10020367
Molecular Weight 241.221 g/mol
Sample ID 56897
Solvent CDCl3