| SpectraBase Compound ID | 3qUb6ouLZgN |
|---|---|
| InChI | InChI=1S/C11H12O3/c1-3-6-14-10-5-4-9(8-12)7-11(10)13-2/h3-5,7-8H,1,6H2,2H3 |
| InChIKey | DGWCHURQYFMBFC-UHFFFAOYSA-N |
| Mol Weight | 192.21 g/mol |
| Molecular Formula | C11H12O3 |
| Exact Mass | 192.078644 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DcSa4a26H56 |
|---|---|
| Name | 4-Alloyloxy-3-methoxybenzaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.078644243 u |
| Formula | C11H12O3 |
| InChI | InChI=1S/C11H12O3/c1-3-6-14-10-5-4-9(8-12)7-11(10)13-2/h3-5,7-8H,1,6H2,2H3 |
| InChIKey | DGWCHURQYFMBFC-UHFFFAOYSA-N |
| Molecular Weight | 192.214 g/mol |
| SMILES | C1(OCC=C)=C(C=C(C=O)C=C1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.976253 |