| SpectraBase Compound ID | AwWM8hjTGqs |
|---|---|
| InChI | InChI=1S/C16H24O2/c1-9(2)12-7-13(10(3)4)15(16(17)18)14(8-12)11(5)6/h7-11H,1-6H3,(H,17,18) |
| InChIKey | ULVHAZFBJJXIDO-UHFFFAOYSA-N |
| Mol Weight | 248.37 g/mol |
| Molecular Formula | C16H24O2 |
| Exact Mass | 248.17763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F2bQLjSFU1u |
|---|---|
| Name | 2,4,6-Triisopropylbenzoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.177630011 u |
| Formula | C16H24O2 |
| InChI | InChI=1S/C16H24O2/c1-9(2)12-7-13(10(3)4)15(16(17)18)14(8-12)11(5)6/h7-11H,1-6H3,(H,17,18) |
| InChIKey | ULVHAZFBJJXIDO-UHFFFAOYSA-N |
| Molecular Weight | 248.366 g/mol |
| SMILES | C1(=C(C(=CC(=C1)C(C)C)C(C)C)C(=O)O)C(C)C |