| SpectraBase Compound ID | FyNiSRRXihI |
|---|---|
| InChI | InChI=1S/C14H17BrO2/c1-3-5-10-16-12-8-7-9-13(14(12)15)17-11-6-4-2/h3-4,7-9H,1-2,5-6,10-11H2 |
| InChIKey | KYBVVZPJVXTNON-UHFFFAOYSA-N |
| Mol Weight | 297.19 g/mol |
| Molecular Formula | C14H17BrO2 |
| Exact Mass | 296.041193 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6tOcvC5sJDc |
|---|---|
| Name | 2-Bromo-1,3-bis(but-3-enoxy)benzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.041192785 u |
| Formula | C14H17BrO2 |
| InChI | InChI=1S/C14H17BrO2/c1-3-5-10-16-12-8-7-9-13(14(12)15)17-11-6-4-2/h3-4,7-9H,1-2,5-6,10-11H2 |
| InChIKey | KYBVVZPJVXTNON-UHFFFAOYSA-N |
| SMILES | C=1(C(=C(C=CC1)OCCC=C)Br)OCCC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.901759 |