| SpectraBase Compound ID | 62BzAKXs5SC |
|---|---|
| InChI | InChI=1S/C18H22O2/c1-18(2,19)13-12-16-10-6-7-11-17(16)20-14-15-8-4-3-5-9-15/h3-11,19H,12-14H2,1-2H3 |
| InChIKey | VWDUKMOUIRYSQO-UHFFFAOYSA-N |
| Mol Weight | 270.37 g/mol |
| Molecular Formula | C18H22O2 |
| Exact Mass | 270.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CSvTX3EkVfl |
|---|---|
| Name | Benzenepropanol, .alpha.,.alpha.-dimethyl-2-(phenylmethoxy)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.161979946 u |
| Formula | C18H22O2 |
| InChI | InChI=1S/C18H22O2/c1-18(2,19)13-12-16-10-6-7-11-17(16)20-14-15-8-4-3-5-9-15/h3-11,19H,12-14H2,1-2H3 |
| InChIKey | VWDUKMOUIRYSQO-UHFFFAOYSA-N |
| Molecular Weight | 270.372 g/mol |
| SMILES | C(OC1=C(CCC(C)(C)O)C=CC=C1)C1=CC=CC=C1 |