| SpectraBase Compound ID | 8z2fItgb72G |
|---|---|
| InChI | InChI=1S/C9H9Br/c10-9-5-3-8(4-6-9)7-1-2-7/h3-7H,1-2H2 |
| InChIKey | JRDNBWVMEFUNCQ-UHFFFAOYSA-N |
| Mol Weight | 197.07 g/mol |
| Molecular Formula | C9H9Br |
| Exact Mass | 195.988763 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1ZBhs5jjdZK |
|---|---|
| Name | 1-Bromo-4-cyclopropylbenzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 195.988763290 u |
| Formula | C9H9Br |
| InChI | InChI=1S/C9H9Br/c10-9-5-3-8(4-6-9)7-1-2-7/h3-7H,1-2H2 |
| InChIKey | JRDNBWVMEFUNCQ-UHFFFAOYSA-N |
| Molecular Weight | 197.075 g/mol |
| SMILES | C1=CC(=CC=C1C1CC1)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.952834 |