Secnidazole
Compound with spectra: 5 NMR, 1 FTIR, and 1 Raman
| 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 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Copyright | Copyright © 2017-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | TCI Chemicals India Pvt. Ltd. |
| Source of Spectrum | Bio-Rad Laboratories, Inc. |
| Catalog Number | S0911 |
| Copyright | Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | TCI Chemicals India Pvt. Ltd. |
| Source of Spectrum | Bio-Rad Laboratories, Inc. |
| Catalog Number | S0911 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
- 1-(2-Methyl-5-nitro-imidazol-1-yl)-propan-2-ol
- KPQZUUQMTUIKBP-UHFFFAOYSA-N
- 1-(2-HYDROXYPROPYL)-2-METHYL-5-NITROIMIDAZOLE
1-[2-(2-CHLOROETHOXY)ETHYL]-2-METHYL-5-NITROIMIDAZOLE
Ornidazole -HCl
2-methyl-5-nitroimdazole-1-acetic acid
Metronidazole TMS
Metronidazole AC
2-(2-Phenylaminovinyl)-1-methyl-5-nitroimidazole
(1-Methyl-5-nitro-1H-imidazol-2-yl)methyl carbamate
Metronidazole-M (HO-methyl-)
RWUVYVBZPSPHCQ-UHFFFAOYSA-N
PHQFITZDQZTBGB-UHFFFAOYSA-N
| Title | Journal or Book | Year |
|---|---|---|
| Probing NMR parameters, structure and dynamics of 5-nitroimidazole derivatives. Density functional study of prototypical radiosensitizers | Magnetic Resonance in Chemistry | 2004 |
| Substituent effects on the15N NMR Parameters of Azoles | Magnetic Resonance in Chemistry | 1997 |
| 15N‐NMR Spectra of Azoles with Two Heteroatoms | Helvetica Chimica Acta | 1983 |
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