| SpectraBase Compound ID | Jqiw6XLV6VZ |
|---|---|
| InChI | InChI=1S/C7H13BrO/c8-6-4-2-1-3-5-7-9/h1-2,9H,3-7H2/b2-1+ |
| InChIKey | CNULWWPYYNLXGN-OWOJBTEDSA-N |
| Mol Weight | 193.08 g/mol |
| Molecular Formula | C7H13BrO |
| Exact Mass | 192.014978 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7l9SgzP3wu0 |
|---|---|
| Name | 7-Bromohept-4-en-1-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.014978038 u |
| Formula | C7H13BrO |
| InChI | InChI=1S/C7H13BrO/c8-6-4-2-1-3-5-7-9/h1-2,9H,3-7H2/b2-1+ |
| InChIKey | CNULWWPYYNLXGN-OWOJBTEDSA-N |
| Molecular Weight | 193.084 g/mol |
| SMILES | C(CC\C=C\CCBr)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.944325 |