| SpectraBase Compound ID | IHXyReZI3ut |
|---|---|
| InChI | InChI=1S/C9H13BrO/c1-7(11-2)8-5-3-4-6-9(8)10/h1,3-6H2,2H3 |
| InChIKey | GOZLCABSWDUNND-UHFFFAOYSA-N |
| Mol Weight | 217.11 g/mol |
| Molecular Formula | C9H13BrO |
| Exact Mass | 216.014978 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EEOawxaSzQZ |
|---|---|
| Name | 1-Bromo-2-(1-methoxyethenyl)cyclohex-1-ene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 216.014978038 u |
| Formula | C9H13BrO |
| InChI | InChI=1S/C9H13BrO/c1-7(11-2)8-5-3-4-6-9(8)10/h1,3-6H2,2H3 |
| InChIKey | GOZLCABSWDUNND-UHFFFAOYSA-N |
| Molecular Weight | 217.106 g/mol |
| SMILES | C1(=C(Br)CCCC1)C(=C)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.951429 |