| SpectraBase Compound ID | 5KX43OWzbKn |
|---|---|
| InChI | InChI=1S/C10H17Br/c1-10(2,3)8-5-4-6-9(11)7-8/h4,6,8-9H,5,7H2,1-3H3 |
| InChIKey | CJDSCKWYBHEAAU-UHFFFAOYSA-N |
| Mol Weight | 217.15 g/mol |
| Molecular Formula | C10H17Br |
| Exact Mass | 216.051364 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2Ejxd5hCNei |
|---|---|
| Name | Cyclohexene, 3-bromo-5-(1,1-dimethylethyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 216.051363547 u |
| Formula | C10H17Br |
| InChI | InChI=1S/C10H17Br/c1-10(2,3)8-5-4-6-9(11)7-8/h4,6,8-9H,5,7H2,1-3H3 |
| InChIKey | CJDSCKWYBHEAAU-UHFFFAOYSA-N |
| Molecular Weight | 217.150 g/mol |
| SMILES | C1(C(C)(C)C)CC(Br)C=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.956324 |