| SpectraBase Compound ID | 4CQ0Gbgxw72 |
|---|---|
| InChI | InChI=1S/C14H19BrO/c1-6-11-14(4,5)12-9(3)10(15)7-8(2)13(12)16-11/h7,11H,6H2,1-5H3 |
| InChIKey | VLISZKFSHVDZBD-UHFFFAOYSA-N |
| Mol Weight | 283.21 g/mol |
| Molecular Formula | C14H19BrO |
| Exact Mass | 282.061928 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IcqbkpuvZDD |
|---|---|
| Name | 5-Bromo-2-ethyl-3,3,4,7-tetramethyl-2,3-dihydrobenzofuran |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.061928231 u |
| Formula | C14H19BrO |
| InChI | InChI=1S/C14H19BrO/c1-6-11-14(4,5)12-9(3)10(15)7-8(2)13(12)16-11/h7,11H,6H2,1-5H3 |
| InChIKey | VLISZKFSHVDZBD-UHFFFAOYSA-N |
| SMILES | C=12C(C(C)(C)C(O2)CC)=C(C)C(=CC1C)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937627 |