| SpectraBase Compound ID | KrZOfdRUjS7 |
|---|---|
| InChI | InChI=1S/C12H12Br2/c13-11-8-4-7-10(12(11)14)9-5-2-1-3-6-9/h1-3,5-6,11H,4,7-8H2 |
| InChIKey | FAALOWKAPQVYOT-UHFFFAOYSA-N |
| Mol Weight | 316.04 g/mol |
| Molecular Formula | C12H12Br2 |
| Exact Mass | 313.930576 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | H2u4ugSgA6g |
|---|---|
| Name | 1,6-Dibromo-2-phenylcyclohex-1-ene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 313.930576386 u |
| Formula | C12H12Br2 |
| InChI | InChI=1S/C12H12Br2/c13-11-8-4-7-10(12(11)14)9-5-2-1-3-6-9/h1-3,5-6,11H,4,7-8H2 |
| InChIKey | FAALOWKAPQVYOT-UHFFFAOYSA-N |
| Molecular Weight | 316.036 g/mol |
| SMILES | C1(=C(C=2C=CC=CC2)CCCC1Br)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.965096 |