| SpectraBase Compound ID | 5nzyt2yRH0L |
|---|---|
| InChI | InChI=1S/C12H15BrO3/c1-7(2)16-12-9(6-14)5-10(13)8(3)11(12)15-4/h5-7H,1-4H3 |
| InChIKey | WCJMYCMVAAVLOR-UHFFFAOYSA-N |
| Mol Weight | 287.15 g/mol |
| Molecular Formula | C12H15BrO3 |
| Exact Mass | 286.020457 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LBz577FSC2H |
|---|---|
| Name | 5-Bromanyl-3-methoxy-4-methyl-2-propan-2-yloxy-benzaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.020457340 u |
| Formula | C12H15BrO3 |
| InChI | InChI=1S/C12H15BrO3/c1-7(2)16-12-9(6-14)5-10(13)8(3)11(12)15-4/h5-7H,1-4H3 |
| InChIKey | WCJMYCMVAAVLOR-UHFFFAOYSA-N |
| SMILES | C1(=C(C(C)=C(C=C1C=O)Br)OC)OC(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.848992 |