| SpectraBase Compound ID | 4M89nqY43mq |
|---|---|
| InChI | InChI=1S/C10H11NO/c1-8(12)11-7-6-9-4-2-3-5-10(9)11/h2-5H,6-7H2,1H3 |
| InChIKey | RNTCWULFNYNFGI-UHFFFAOYSA-N |
| Mol Weight | 161.2 g/mol |
| Molecular Formula | C10H11NO |
| Exact Mass | 161.084064 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | BsC7ebd6Rke |
|---|---|
| Name | 1-Acetylindoline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 161.084063977 u |
| Formula | C10H11NO |
| InChI | InChI=1S/C10H11NO/c1-8(12)11-7-6-9-4-2-3-5-10(9)11/h2-5H,6-7H2,1H3 |
| InChIKey | RNTCWULFNYNFGI-UHFFFAOYSA-N |
| Molecular Weight | 161.204 g/mol |
| SMILES | C=12C=CC=CC1N(CC2)C(C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.984703 |