| SpectraBase Compound ID | 4MiKuMkguYP |
|---|---|
| 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 |
15N Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5S1gzEtjT7c |
|---|---|
| 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 | UWSI27621 |