| SpectraBase Compound ID | 4Em4b1808Hp |
|---|---|
| InChI | InChI=1S/C9H7NO2/c11-9-8-4-2-1-3-7(8)5-6-10(9)12/h1-6,12H/i12D |
| InChIKey | FPDYOSFKYCMRME-UQBWLURTSA-N |
| Mol Weight | 162.17 g/mol |
| Molecular Formula | C9H6DNO2 |
| Exact Mass | 162.053955 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KQluUrNfnmB |
|---|---|
| Name | 2-Deuteroxy-1(2H)-isoquinolone |
| CAS Registry Number | 24769-31-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H6DNO2 |
| InChI | InChI=1S/C9H7NO2/c11-9-8-4-2-1-3-7(8)5-6-10(9)12/h1-6,12H/i12D |
| InChIKey | FPDYOSFKYCMRME-UQBWLURTSA-N |
| Molecular Weight | 162.166 g/mol |
| SMILES | C1(N(C=Cc2c1cccc2)O[D])=O |
| SPLASH | splash10-03di-6900000000-c0ef71fd23a7dcf62b79 |
| Source of Spectrum | O-2-682-10 |
| Wiley ID | 12984 |