| SpectraBase Compound ID | GHh5O8dxQFB |
|---|---|
| InChI | InChI=1S/C16H16O2/c1-12-8-9-16(18-13(2)17)15(10-12)11-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3 |
| InChIKey | KRHSEULRIQRRTB-UHFFFAOYSA-N |
| Mol Weight | 240.3 g/mol |
| Molecular Formula | C16H16O2 |
| Exact Mass | 240.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FTQNUU8tCso |
|---|---|
| Name | 2-Benzyl-4-methylphenol, acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.115029753 u |
| Formula | C16H16O2 |
| InChI | InChI=1S/C16H16O2/c1-12-8-9-16(18-13(2)17)15(10-12)11-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3 |
| InChIKey | KRHSEULRIQRRTB-UHFFFAOYSA-N |
| Molecular Weight | 240.302 g/mol |
| SMILES | C1(OC(C)=O)=C(C=C(C=C1)C)CC1=CC=CC=C1 |