| SpectraBase Compound ID | EapGQBbfWAj |
|---|---|
| InChI | InChI=1S/C10H15NO3/c1-13-8-5-7(3-4-11)6-9(14-2)10(8)12/h5-6,12H,3-4,11H2,1-2H3 |
| InChIKey | ISVPPMXWQFCRSS-UHFFFAOYSA-N |
| Mol Weight | 197.23 g/mol |
| Molecular Formula | C10H15NO3 |
| Exact Mass | 197.105193 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KaeASX75HsR |
|---|---|
| Name | 3,5-Dimethoxy-4-hydroxyphenethylamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 197.105193344 u |
| Formula | C10H15NO3 |
| InChI | InChI=1S/C10H15NO3/c1-13-8-5-7(3-4-11)6-9(14-2)10(8)12/h5-6,12H,3-4,11H2,1-2H3 |
| InChIKey | ISVPPMXWQFCRSS-UHFFFAOYSA-N |
| Molecular Weight | 197.234 g/mol |
| SMILES | C1=C(C=C(C(=C1OC)O)OC)CCN |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.889549 |