| SpectraBase Compound ID | D9anq88pObt |
|---|---|
| InChI | InChI=1S/C19H30O3/c1-4-5-6-7-8-9-10-11-14-17(20)16-13-12-15-18(21-2)19(16)22-3/h12-13,15H,4-11,14H2,1-3H3 |
| InChIKey | QKCOGIQCUAJIHZ-UHFFFAOYSA-N |
| Mol Weight | 306.45 g/mol |
| Molecular Formula | C19H30O3 |
| Exact Mass | 306.219495 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4Kf02Nykbgw |
|---|---|
| Name | (2,3-Dimethoxyphenyl) decyl ketone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.219494823 u |
| Formula | C19H30O3 |
| InChI | InChI=1S/C19H30O3/c1-4-5-6-7-8-9-10-11-14-17(20)16-13-12-15-18(21-2)19(16)22-3/h12-13,15H,4-11,14H2,1-3H3 |
| InChIKey | QKCOGIQCUAJIHZ-UHFFFAOYSA-N |
| SMILES | C=1(C(=C(OC)C=CC1)OC)C(=O)CCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.893456 |