| SpectraBase Compound ID | 38TrzokZVYT |
|---|---|
| InChI | InChI=1S/C10H13NO2/c1-13-10-4-2-3-9(7-10)5-6-11-8-12/h2-4,7-8H,5-6H2,1H3,(H,11,12) |
| InChIKey | ZTFODYARLDKLAZ-UHFFFAOYSA-N |
| Mol Weight | 179.22 g/mol |
| Molecular Formula | C10H13NO2 |
| Exact Mass | 179.094629 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | OvqRbpNGHB |
|---|---|
| Name | 3-Methoxyphenethylamine form |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 179.094628661 u |
| Formula | C10H13NO2 |
| InChI | InChI=1S/C10H13NO2/c1-13-10-4-2-3-9(7-10)5-6-11-8-12/h2-4,7-8H,5-6H2,1H3,(H,11,12) |
| InChIKey | ZTFODYARLDKLAZ-UHFFFAOYSA-N |
| Molecular Weight | 179.219 g/mol |
| SMILES | C=1(C=C(C=CC1)OC)CCNC=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.851738 |