| SpectraBase Compound ID | 7PkQXV4EJVr |
|---|---|
| InChI | InChI=1S/C12H24O3/c1-8(2)10(13)7-9(3)11(14)15-12(4,5)6/h8-10,13H,7H2,1-6H3 |
| InChIKey | FAZAVJQPLMLQIZ-UHFFFAOYSA-N |
| Mol Weight | 216.32 g/mol |
| Molecular Formula | C12H24O3 |
| Exact Mass | 216.172545 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ANj26PG9w0O |
|---|---|
| Name | Tert-butyl 4-hydroxy-2,5-dimethylhexanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 216.172544630 u |
| Formula | C12H24O3 |
| InChI | InChI=1S/C12H24O3/c1-8(2)10(13)7-9(3)11(14)15-12(4,5)6/h8-10,13H,7H2,1-6H3 |
| InChIKey | FAZAVJQPLMLQIZ-UHFFFAOYSA-N |
| Molecular Weight | 216.321 g/mol |
| SMILES | C(OC(C)(C)C)(C(CC(C(C)C)O)C)=O |