| SpectraBase Compound ID | pMDlbDq9Uc |
|---|---|
| InChI | InChI=1S/C19H22O2/c1-14(2)18(20)21-17-12-10-16(11-13-17)19(3,4)15-8-6-5-7-9-15/h5-14H,1-4H3 |
| InChIKey | IANCYIKCRBEOGU-UHFFFAOYSA-N |
| Mol Weight | 282.38 g/mol |
| Molecular Formula | C19H22O2 |
| Exact Mass | 282.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2cvJHiAtpTx |
|---|---|
| Name | 4-Cumylphenol, 2-methylpropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.161979946 u |
| Formula | C19H22O2 |
| InChI | InChI=1S/C19H22O2/c1-14(2)18(20)21-17-12-10-16(11-13-17)19(3,4)15-8-6-5-7-9-15/h5-14H,1-4H3 |
| InChIKey | IANCYIKCRBEOGU-UHFFFAOYSA-N |
| SMILES | C1(OC(C(C)C)=O)=CC=C(C=C1)C(C)(C)C1=CC=CC=C1 |