| SpectraBase Compound ID | 8i213UM9ZHa |
|---|---|
| InChI | InChI=1S/C8H15NO3/c1-4-7(10)5-6-8(2,3)9(11)12/h4-6H2,1-3H3/i4D2,5D2 |
| InChIKey | OFWDOBHRXFXQJT-CQOLUAMGSA-N |
| Mol Weight | 177.24 g/mol |
| Molecular Formula | C8H11D4NO3 |
| Exact Mass | 177.1303 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Koogq8RLU56 |
|---|---|
| Name | 2,2,4,4-Tetradeutero-6-methyl-6-nitro-3-heptanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H11D4NO3 |
| InChI | InChI=1S/C8H15NO3/c1-4-7(10)5-6-8(2,3)9(11)12/h4-6H2,1-3H3/i4D2,5D2 |
| InChIKey | OFWDOBHRXFXQJT-CQOLUAMGSA-N |
| Molecular Weight | 177.236 g/mol |
| SMILES | C(N(=O)=O)(CC(C(=O)C(C)([D])[D])([D])[D])(C)C |
| SPLASH | splash10-0a4i-9000000000-157562e9569ad4189be0 |
| Source of Spectrum | O-27-741-0 |
| Wiley ID | 1169726 |