| SpectraBase Compound ID | CfxYXMwCy6S |
|---|---|
| InChI | InChI=1S/C9H13Br/c10-8-4-3-7-9-5-1-2-6-9/h1-2,5H,3-4,6-8H2 |
| InChIKey | XCZUHGOJDDVIOY-UHFFFAOYSA-N |
| Mol Weight | 201.11 g/mol |
| Molecular Formula | C9H13Br |
| Exact Mass | 200.020063 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | hvLGJMm19v |
|---|---|
| Name | 4-Bromobutylcyclopentadiene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.020063419 u |
| Formula | C9H13Br |
| InChI | InChI=1S/C9H13Br/c10-8-4-3-7-9-5-1-2-6-9/h1-2,5H,3-4,6-8H2 |
| InChIKey | XCZUHGOJDDVIOY-UHFFFAOYSA-N |
| Molecular Weight | 201.107 g/mol |
| SMILES | C1(=CC=CC1)CCCCBr |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.940187 |