| SpectraBase Compound ID | ImOSlY6IZxZ |
|---|---|
| InChI | InChI=1S/C24H25Br/c25-19-24(22-14-8-3-9-15-22)18-23(21-12-6-2-7-13-21)17-16-20-10-4-1-5-11-20/h1-15,23-24H,16-19H2 |
| InChIKey | RCBOMJNOAAFTQS-UHFFFAOYSA-N |
| Mol Weight | 393.37 g/mol |
| Molecular Formula | C24H25Br |
| Exact Mass | 392.113964 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KwlXkXtTprb |
|---|---|
| Name | 1-Bromo-2,4,6-triphenylhexane(alpha-epimer) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 392.113963805 u |
| Formula | C24H25Br |
| InChI | InChI=1S/C24H25Br/c25-19-24(22-14-8-3-9-15-22)18-23(21-12-6-2-7-13-21)17-16-20-10-4-1-5-11-20/h1-15,23-24H,16-19H2 |
| InChIKey | RCBOMJNOAAFTQS-UHFFFAOYSA-N |
| Molecular Weight | 393.368 g/mol |
| SMILES | C=1C(=CC=CC1)CCC(CC(C=1C=CC=CC1)CBr)C=1C=CC=CC1 |