| SpectraBase Compound ID | J2FcQr0vFmH |
|---|---|
| InChI | InChI=1S/C23H22O3/c1-26-22(24)17-21(18-11-5-2-6-12-18)23(25,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16,21,25H,17H2,1H3 |
| InChIKey | KBQGULLXLVJPDT-UHFFFAOYSA-N |
| Mol Weight | 346.43 g/mol |
| Molecular Formula | C23H22O3 |
| Exact Mass | 346.156895 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1UXRYakWWTm |
|---|---|
| Name | Methyl 4-hydroxy-3,4,4-triphenylbutanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 346.156894565 u |
| Formula | C23H22O3 |
| InChI | InChI=1S/C23H22O3/c1-26-22(24)17-21(18-11-5-2-6-12-18)23(25,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16,21,25H,17H2,1H3 |
| InChIKey | KBQGULLXLVJPDT-UHFFFAOYSA-N |
| Molecular Weight | 346.426 g/mol |
| SMILES | C(C(CC(=O)OC)C1=CC=CC=C1)(C=1C=CC=CC1)(C1=CC=CC=C1)O |