| SpectraBase Compound ID | BG33MvWeEA6 |
|---|---|
| InChI | InChI=1S/C12H20O3/c1-7(2)12-14-9-6-4-5-8(3)10(9)11(13)15-12/h7-10,12H,4-6H2,1-3H3 |
| InChIKey | XKPKBPRMTQWXQU-UHFFFAOYSA-N |
| Mol Weight | 212.29 g/mol |
| Molecular Formula | C12H20O3 |
| Exact Mass | 212.141245 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6vUR9VRUwsw |
|---|---|
| Name | 2-Isopropyl-5-methylhexahydro-4H-1,3-benzodioxin-4-one |
| Alternate Name(s) | 2,4-Dioxabicyclo[4.4.0]decan-5-one, 3-isobutyl-7-methyl-, (1R,3S,6R) 2-isopropyl-5-methyl-4a,5,6,7,8,8a-hexahydrobenzo[d][1,3]dioxin-4-one 5-Methyl-2-propan-2-yl-4a,5,6,7,8,8a-hexahydrobenzo[d][1,3]dioxin-4-one |
| CAS Registry Number | 124899-16-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H20O3 |
| InChI | InChI=1S/C12H20O3/c1-7(2)12-14-9-6-4-5-8(3)10(9)11(13)15-12/h7-10,12H,4-6H2,1-3H3 |
| InChIKey | XKPKBPRMTQWXQU-UHFFFAOYSA-N |
| Molecular Weight | 212.289 g/mol |
| SMILES | C12C(CCCC2C)OC(OC1=O)C(C)C |
| SPLASH | splash10-007k-9200000000-b6dd09c596577a89662d |
| Source of Spectrum | CM-1999-12253-0 |
| Wiley ID | 474607 |