| SpectraBase Compound ID | 9lZJNMkgmEf |
|---|---|
| InChI | InChI=1S/C12H15NO/c1-8-12(2,3)10-7-9(14-4)5-6-11(10)13-8/h5-7H,1-4H3 |
| InChIKey | UOGHZHPESMATDD-UHFFFAOYSA-N |
| Mol Weight | 189.26 g/mol |
| Molecular Formula | C12H15NO |
| Exact Mass | 189.115364 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6qwXondmNsA |
|---|---|
| Name | 5-Methoxy-2,3,3-trimethyl-3H-indole |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.115364106 u |
| Formula | C12H15NO |
| InChI | InChI=1S/C12H15NO/c1-8-12(2,3)10-7-9(14-4)5-6-11(10)13-8/h5-7H,1-4H3 |
| InChIKey | UOGHZHPESMATDD-UHFFFAOYSA-N |
| Molecular Weight | 189.258 g/mol |
| SMILES | C1(=NC=2C(C1(C)C)=CC(=CC2)OC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.884163 |