| SpectraBase Compound ID | AxkhAQ8dvJL |
|---|---|
| InChI | InChI=1S/C8H16O/c1-3-5-6-7-8(9)4-2/h3-7H2,1-2H3/i4D2,5D2,7D2 |
| InChIKey | RHLVCLIPMVJYKS-NWYZMDSRSA-N |
| Mol Weight | 134.25 g/mol |
| Molecular Formula | C8H10D6O |
| Exact Mass | 134.157776 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GLYtJdL2qa7 |
|---|---|
| Name | 3-Octanone-2,2,4,4,6,6-D6 |
| CAS Registry Number | 19265-37-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H10D6O |
| InChI | InChI=1S/C8H16O/c1-3-5-6-7-8(9)4-2/h3-7H2,1-2H3/i4D2,5D2,7D2 |
| InChIKey | RHLVCLIPMVJYKS-NWYZMDSRSA-N |
| Molecular Weight | 134.252 g/mol |
| SMILES | C(=O)(C(C)([D])[D])C(CC(CC)([D])[D])([D])[D] |
| SPLASH | splash10-0udi-5900000000-4f89370ad305dac21c2f |
| Source of Spectrum | C-90-162-4 |
| Wiley ID | 1131578 |