| SpectraBase Compound ID | 2RY8M9tsqU1 |
|---|---|
| InChI | InChI=1S/C17H19BrO2/c1-19-17(13-14-5-3-2-4-6-14)11-12-20-16-9-7-15(18)8-10-16/h2-10,17H,11-13H2,1H3 |
| InChIKey | RNGIZAYMFLWRGQ-UHFFFAOYSA-N |
| Mol Weight | 335.24 g/mol |
| Molecular Formula | C17H19BrO2 |
| Exact Mass | 334.056843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HWwOGyZe9iF |
|---|---|
| Name | 1-(3-Methoxy-4-phenylbutoxy)-4-bromobenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 334.056842850 u |
| Formula | C17H19BrO2 |
| InChI | InChI=1S/C17H19BrO2/c1-19-17(13-14-5-3-2-4-6-14)11-12-20-16-9-7-15(18)8-10-16/h2-10,17H,11-13H2,1H3 |
| InChIKey | RNGIZAYMFLWRGQ-UHFFFAOYSA-N |
| Molecular Weight | 335.241 g/mol |
| SMILES | C=1(C=CC(=CC1)Br)OCCC(CC=1C=CC=CC1)OC |