| SpectraBase Compound ID | 9WaWnpVKbef |
|---|---|
| InChI | InChI=1S/C9H7N3O2/c13-12(14)9-4-2-1-3-8(9)11-6-5-10-7-11/h1-7H/i5D,6D |
| InChIKey | HESJLLCGKVDGIB-KCZCTXNHSA-N |
| Mol Weight | 191.19 g/mol |
| Molecular Formula | C9H52D2N3O2 |
| Exact Mass | 191.06638 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BNSyb7BskTH |
|---|---|
| Name | 1-(o-nitrophenyl)-4,5-dideuteroimidazole |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H5D2N3O2 |
| InChI | InChI=1S/C9H7N3O2/c13-12(14)9-4-2-1-3-8(9)11-6-5-10-7-11/h1-7H/i5D,6D |
| InChIKey | HESJLLCGKVDGIB-KCZCTXNHSA-N |
| Molecular Weight | 191.186 g/mol |
| SMILES | c1(N(=O)=O)c(-[n]2cnc(c2[2D])[2D])cccc1 |
| SPLASH | splash10-0a6u-9600000000-bafd7fd6d13158c99ecc |
| Source of Spectrum | O-13-576-1 |
| Wiley ID | 1185507 |