| SpectraBase Compound ID | FfXpCmhf11e |
|---|---|
| InChI | InChI=1S/C13H20O3/c1-4-5-6-9-16-11-7-8-12(14-2)13(10-11)15-3/h7-8,10H,4-6,9H2,1-3H3 |
| InChIKey | UPSOIZBWVCOYFD-UHFFFAOYSA-N |
| Mol Weight | 224.3 g/mol |
| Molecular Formula | C13H20O3 |
| Exact Mass | 224.141245 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BJ4pajfewT8 |
|---|---|
| Name | 3,4-Dimethoxyphenol, N-pentyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.141244501 u |
| Formula | C13H20O3 |
| InChI | InChI=1S/C13H20O3/c1-4-5-6-9-16-11-7-8-12(14-2)13(10-11)15-3/h7-8,10H,4-6,9H2,1-3H3 |
| InChIKey | UPSOIZBWVCOYFD-UHFFFAOYSA-N |
| Molecular Weight | 224.300 g/mol |
| SMILES | C1=C(C(=CC=C1OCCCCC)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.958207 |