| SpectraBase Compound ID | ESqJnQyscYG |
|---|---|
| InChI | InChI=1S/C9H16O3/c1-6-5-7(10)12-8(11-6)9(2,3)4/h6,8H,5H2,1-4H3/i5D |
| InChIKey | SFWUTHYTQUXJTB-UICOGKGYSA-N |
| Mol Weight | 173.23 g/mol |
| Molecular Formula | C9H15DO3 |
| Exact Mass | 173.116221 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3K1tHJqot86 |
|---|---|
| Name | 2-tert-Butyl-5-deutero-6-methyl-1,3-dioxan-4-one |
| CAS Registry Number | 114885-91-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H15DO3 |
| InChI | InChI=1S/C9H16O3/c1-6-5-7(10)12-8(11-6)9(2,3)4/h6,8H,5H2,1-4H3/i5D |
| InChIKey | SFWUTHYTQUXJTB-UICOGKGYSA-N |
| Molecular Weight | 173.230 g/mol |
| SMILES | CC(C1OC(C(C(O1)=O)[D])C)(C)C |
| SPLASH | splash10-0avl-9000000000-e4664ca46fe6be37bcd4 |
| Wiley ID | 1489609 |