| SpectraBase Compound ID | 31rarOkrN1K |
|---|---|
| InChI | InChI=1S/C16H26O/c1-15-12-10-8-6-4-2-3-5-7-9-11-13-16(17)14-15/h15H,2-7,9,11-14H2,1H3/i1D3 |
| InChIKey | KQTDQEVMOUHOAX-FIBGUPNXSA-N |
| Mol Weight | 237.4 g/mol |
| Molecular Formula | C16H232D3O |
| Exact Mass | 237.217196 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ICnlDhlm0nN |
|---|---|
| Name | 3-(Trideuteriomethyl)cyclopentadec-5-yn-1-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H23D3O |
| InChI | InChI=1S/C16H26O/c1-15-12-10-8-6-4-2-3-5-7-9-11-13-16(17)14-15/h15H,2-7,9,11-14H2,1H3/i1D3 |
| InChIKey | KQTDQEVMOUHOAX-FIBGUPNXSA-N |
| Molecular Weight | 237.401 g/mol |
| SMILES | C1#CCCCCCCCCCC(CC(C1)C([2D])([2D])[2D])=O |
| SPLASH | splash10-0564-9400000000-853290310472d06452e5 |
| Source of Spectrum | H-92-1797-31 |
| Wiley ID | 1693698 |