| SpectraBase Compound ID | EsQSVGrvPhm |
|---|---|
| InChI | InChI=1S/C11H19BrO3/c12-7-3-1-2-6-11(13)15-9-10-5-4-8-14-10/h10H,1-9H2 |
| InChIKey | YMLRNXHEYRJSGN-UHFFFAOYSA-N |
| Mol Weight | 279.17 g/mol |
| Molecular Formula | C11H19BrO3 |
| Exact Mass | 278.051757 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IBp24WH1YLr |
|---|---|
| Name | 6-Bromohexanoic acid, 2-tetrahydrofurylmethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.051757469 u |
| Formula | C11H19BrO3 |
| InChI | InChI=1S/C11H19BrO3/c12-7-3-1-2-6-11(13)15-9-10-5-4-8-14-10/h10H,1-9H2 |
| InChIKey | YMLRNXHEYRJSGN-UHFFFAOYSA-N |
| SMILES | C1OC(CC1)COC(CCCCCBr)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.96507 |