| SpectraBase Compound ID | 6WqUi9T67uo |
|---|---|
| InChI | InChI=1S/C7H12O3/c1-5-6(8)4-9-7(2,3)10-5/h5H,4H2,1-3H3/t5-/m0/s1 |
| InChIKey | QJSYQETVQMAYGG-YFKPBYRVSA-N |
| Mol Weight | 144.17 g/mol |
| Molecular Formula | C7H12O3 |
| Exact Mass | 144.078644 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HL9HdJvzMb7 |
|---|---|
| Name | (S)-2,2,6-Trimethyl-1,3-dioxan-5-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O3 |
| InChI | InChI=1S/C7H12O3/c1-5-6(8)4-9-7(2,3)10-5/h5H,4H2,1-3H3/t5-/m0/s1 |
| InChIKey | QJSYQETVQMAYGG-YFKPBYRVSA-N |
| Molecular Weight | 144.170 g/mol |
| SMILES | C1(O[C@](C(CO1)=O)(C)[H])(C)C |
| SPLASH | splash10-006x-9000000000-285f8825bd05a4a03aa7 |
| Source of Spectrum | SO-64-495-5 |
| Synonyms | (4S)-2,2,4-trimethyl-1,3-dioxan-5-one |
| Wiley ID | 1540771 |