SpectraBase Compound ID | 4MiKuMkguYP |
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InChI | InChI=1S/C7H11N3O3/c1-5(11)4-9-6(2)8-3-7(9)10(12)13/h3,5,11H,4H2,1-2H3 |
InChIKey | KPQZUUQMTUIKBP-UHFFFAOYSA-N |
Mol Weight | 185.18 g/mol |
Molecular Formula | C7H11N3O3 |
Exact Mass | 185.080041 g/mol |
SpectraBase Spectrum ID | 9lEfOaifBwt |
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Name | SECNIDAZOLE |
Compound Number | 2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C7H11N3O3 |
InChI | InChI=1S/C7H11N3O3/c1-5(11)4-9-6(2)8-3-7(9)10(12)13/h3,5,11H,4H2,1-2H3 |
InChIKey | KPQZUUQMTUIKBP-UHFFFAOYSA-N |
Literature Reference Author | T.C.RAMALHO,M.BUEHL |
Literature Reference Citation | MAGN.RES.CHEM.,43,139(2005) |
Literature Reference DOI | 10.1002/mrc.1514 |
Solvent | DMSO-D6 |
Source File Reference | UWSI27530 |