| SpectraBase Compound ID | KwjEUM01goi |
|---|---|
| InChI | InChI=1S/C9H8N2O2/c10-7-5-6-3-1-2-4-8(6)11(13)9(7)12/h1-5,13H,10H2/i13D/hD2 |
| InChIKey | JREFLKGIMBMLNU-GAVYOJEMSA-N |
| Mol Weight | 179.19 g/mol |
| Molecular Formula | C9H5D3N2O2 |
| Exact Mass | 179.077408 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ApMv8CDfXmo |
|---|---|
| Name | 3-Deuteroamino-1-deuteroxy-2(1H)quinolone |
| CAS Registry Number | 24769-29-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H5D3N2O2 |
| InChI | InChI=1S/C9H8N2O2/c10-7-5-6-3-1-2-4-8(6)11(13)9(7)12/h1-5,13H,10H2/i13D/hD2 |
| InChIKey | JREFLKGIMBMLNU-GAVYOJEMSA-N |
| Molecular Weight | 179.193 g/mol |
| SMILES | C1(N(c2ccccc2C=C1N([D])[D])O[D])=O |
| SPLASH | splash10-0059-3900000000-d1c47753e5e11fedcb24 |
| Source of Spectrum | O-2-682-8 |
| Wiley ID | 17050 |