| SpectraBase Compound ID | 23ZXBH8D1xd |
|---|---|
| InChI | InChI=1S/C9H13Br/c1-5-6(2)8(4)9(10)7(5)3/h9H,1-4H3 |
| InChIKey | ACADNYJNYQSPFZ-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 | 7izZRF8GLY4 |
|---|---|
| Name | 5-Bromo-1,2,3,4-tetramethyl-1,3-cyclopentadiene |
| 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/c1-5-6(2)8(4)9(10)7(5)3/h9H,1-4H3 |
| InChIKey | ACADNYJNYQSPFZ-UHFFFAOYSA-N |
| Molecular Weight | 201.107 g/mol |
| SMILES | C1(Br)C(C)=C(C)C(C)=C1C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.841538 |