| SpectraBase Compound ID | 21YTzefXsQc |
|---|---|
| InChI | InChI=1S/C17H15BrO2/c18-13-8-5-12(6-9-13)16(19)15-10-7-11-3-1-2-4-14(11)17(15)20/h1-6,8-9,15-16,19H,7,10H2 |
| InChIKey | PNPJMRUQMJGBCS-UHFFFAOYSA-N |
| Mol Weight | 331.21 g/mol |
| Molecular Formula | C17H15BrO2 |
| Exact Mass | 330.025543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7CHvQKfDKVx |
|---|---|
| Name | 2-(1'-(p-Bromophenyl)-1'-hydroxymethyl)-1-tetralone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 330.025542721 u |
| Formula | C17H15BrO2 |
| InChI | InChI=1S/C17H15BrO2/c18-13-8-5-12(6-9-13)16(19)15-10-7-11-3-1-2-4-14(11)17(15)20/h1-6,8-9,15-16,19H,7,10H2 |
| InChIKey | PNPJMRUQMJGBCS-UHFFFAOYSA-N |
| Molecular Weight | 331.209 g/mol |
| SMILES | C1(C(C(C=2C=CC(=CC2)Br)O)CCC2=C1C=CC=C2)=O |