| SpectraBase Compound ID | 5QRROyORdd8 |
|---|---|
| InChI | InChI=1S/C6H12O/c1-3-4-6(2)5-7/h5-6H,3-4H2,1-2H3/i1D3 |
| InChIKey | FTZILAQGHINQQR-FIBGUPNXSA-N |
| Mol Weight | 103.18 g/mol |
| Molecular Formula | C6H9D3O |
| Exact Mass | 103.107645 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ClBHx7hfSKj |
|---|---|
| Name | 2-Methylpentanal-5-D3 |
| CAS Registry Number | 28839-46-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H9D3O |
| InChI | InChI=1S/C6H12O/c1-3-4-6(2)5-7/h5-6H,3-4H2,1-2H3/i1D3 |
| InChIKey | FTZILAQGHINQQR-FIBGUPNXSA-N |
| Molecular Weight | 103.179 g/mol |
| SMILES | C(=O)C(CCC([D])([D])[D])C |
| SPLASH | splash10-0a4m-9000000000-418863165fcfde6ea4e6 |
| Source of Spectrum | O-3-684-1 |
| Wiley ID | 1734 |