| SpectraBase Compound ID | GZ8o2X7bUh5 |
|---|---|
| InChI | InChI=1S/C7H14O/c1-2-3-4-5-6-7-8/h7H,2-6H2,1H3/i6D2 |
| InChIKey | FXHGMKSSBGDXIY-NCYHJHSESA-N |
| Mol Weight | 116.2 g/mol |
| Molecular Formula | C7H12D2O |
| Exact Mass | 116.117019 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2Zb7cuvbTEL |
|---|---|
| Name | 2,2-Dideuterio-1-heptanal |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12D2O |
| InChI | InChI=1S/C7H14O/c1-2-3-4-5-6-7-8/h7H,2-6H2,1H3/i6D2 |
| InChIKey | FXHGMKSSBGDXIY-NCYHJHSESA-N |
| Molecular Weight | 116.200 g/mol |
| SMILES | C(C(CCCCC)([D])[D])=O |
| SPLASH | splash10-0002-9000000000-ad93d0d9de9cf57a59ad |
| Source of Spectrum | F9-1985-829-14 |
| Wiley ID | 1565553 |