| SpectraBase Compound ID | 2GrUSPqmPHI |
|---|---|
| InChI | InChI=1S/C10H17Br/c1-9(2)5-4-6-10(3)7-8-11/h5,7H,4,6,8H2,1-3H3/b10-7+ |
| InChIKey | JSCUZAYKVZXKQE-JXMROGBWSA-N |
| Mol Weight | 217.15 g/mol |
| Molecular Formula | C10H17Br |
| Exact Mass | 216.051364 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | AEKFz1g2iAn |
|---|---|
| Name | (2E)-1-Bromo-3,7-dimethylocta-2,6-diene |
| 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/c1-9(2)5-4-6-10(3)7-8-11/h5,7H,4,6,8H2,1-3H3/b10-7+ |
| InChIKey | JSCUZAYKVZXKQE-JXMROGBWSA-N |
| Molecular Weight | 217.150 g/mol |
| SMILES | C(Br)\C=C\(CCC=C(C)C)C |
| Spectrum/Structure Validation Score (Raman) | 0.977507 |