| SpectraBase Compound ID | 6AbBiVjmPa2 |
|---|---|
| InChI | InChI=1S/C16H11Br/c17-13-12-16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h1-11H/b7-6+ |
| InChIKey | KJKUSAZTMHZZSB-VOTSOKGWSA-N |
| Mol Weight | 283.17 g/mol |
| Molecular Formula | C16H11Br |
| Exact Mass | 282.004413 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LZsKnRj1AUH |
|---|---|
| Name | 1-Bromo-2-((E)-4-stilbenyl)ethyne |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.004413354 u |
| Formula | C16H11Br |
| InChI | InChI=1S/C16H11Br/c17-13-12-16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h1-11H/b7-6+ |
| InChIKey | KJKUSAZTMHZZSB-VOTSOKGWSA-N |
| SMILES | C(#CC=1C=CC(\C=C\C=2C=CC=CC2)=CC1)Br |