| SpectraBase Compound ID | FPqBSRX5cXF |
|---|---|
| InChI | InChI=1S/C20H24O3/c1-13-6-8-17(21)15(10-13)12-16-11-14(2)7-9-18(16)23-19(22)20(3,4)5/h6-11,21H,12H2,1-5H3 |
| InChIKey | NTSZYTDCKLNZJZ-UHFFFAOYSA-N |
| Mol Weight | 312.41 g/mol |
| Molecular Formula | C20H24O3 |
| Exact Mass | 312.172545 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CB5PeFkfFW3 |
|---|---|
| Name | 4,4'-Dimethyl-2,2'-methylenediphenol, trimethylacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.172544630 u |
| Formula | C20H24O3 |
| InChI | InChI=1S/C20H24O3/c1-13-6-8-17(21)15(10-13)12-16-11-14(2)7-9-18(16)23-19(22)20(3,4)5/h6-11,21H,12H2,1-5H3 |
| InChIKey | NTSZYTDCKLNZJZ-UHFFFAOYSA-N |
| Molecular Weight | 312.409 g/mol |
| SMILES | C1(OC(C(C)(C)C)=O)=C(C=C(C=C1)C)CC1=C(C=CC(=C1)C)O |