| SpectraBase Compound ID | pcOIpi43ps |
|---|---|
| InChI | InChI=1S/C10H13NO/c1-8(2)7-12-10-6-4-3-5-9(10)11/h3-6H,1,7,11H2,2H3 |
| InChIKey | KXWXNGOHHAPVBZ-UHFFFAOYSA-N |
| Mol Weight | 163.22 g/mol |
| Molecular Formula | C10H13NO |
| Exact Mass | 163.099714 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8hGhycfxzyP |
|---|---|
| Name | 2-(2-Methylallyloxy)aniline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 163.099714042 u |
| Formula | C10H13NO |
| InChI | InChI=1S/C10H13NO/c1-8(2)7-12-10-6-4-3-5-9(10)11/h3-6H,1,7,11H2,2H3 |
| InChIKey | KXWXNGOHHAPVBZ-UHFFFAOYSA-N |
| Molecular Weight | 163.220 g/mol |
| SMILES | C=1(OCC(=C)C)C(N)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.90572 |