![3-Bromo-2-methylnaphtho[1,2-b]pyran-4-one](/api/spectrum/YqOlKyrhUL/structure.png?h=300&w=458 "3-Bromo-2-methylnaphtho[1,2-b]pyran-4-one")
| SpectraBase Compound ID | BgjPYOe56s1 |
|---|---|
| InChI | InChI=1S/C14H9BrO2/c1-8-12(15)13(16)11-7-6-9-4-2-3-5-10(9)14(11)17-8/h2-7H,1H3 |
| InChIKey | IVKKKJYNRWNAFH-UHFFFAOYSA-N |
| Mol Weight | 289.13 g/mol |
| Molecular Formula | C14H9BrO2 |
| Exact Mass | 287.978593 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | YqOlKyrhUL |
|---|---|
| Name | 3-Bromo-2-methylnaphtho[1,2-B]pyran-4-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.978592528 u |
| Formula | C14H9BrO2 |
| InChI | InChI=1S/C14H9BrO2/c1-8-12(15)13(16)11-7-6-9-4-2-3-5-10(9)14(11)17-8/h2-7H,1H3 |
| InChIKey | IVKKKJYNRWNAFH-UHFFFAOYSA-N |
| SMILES | C=12C(C(C(=C(O2)C)Br)=O)=CC=C2C=CC=CC12 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.935575 |