| SpectraBase Compound ID | IDgtugCz88a |
|---|---|
| InChI | InChI=1S/C12H16N2O/c1-9(15)13-7-6-10-8-14-12-5-3-2-4-11(10)12/h2-5,10,14H,6-8H2,1H3,(H,13,15) |
| InChIKey | LGWUGAXPKZWKCB-UHFFFAOYSA-N |
| Mol Weight | 204.27 g/mol |
| Molecular Formula | C12H16N2O |
| Exact Mass | 204.126263 g/mol |
| SpectraBase Spectrum ID | 8QxV21vfoI2 |
|---|---|
| Name | N-[2-(3-Indolinyl)ethyl]acetamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.126263142 u |
| Formula | C12H16N2O |
| InChI | InChI=1S/C12H16N2O/c1-9(15)13-7-6-10-8-14-12-5-3-2-4-11(10)12/h2-5,10,14H,6-8H2,1H3,(H,13,15) |
| InChIKey | LGWUGAXPKZWKCB-UHFFFAOYSA-N |
| SMILES | N1C=2C=CC=CC2C(CCNC(=O)C)C1 |
| Spectrum/Structure Validation Score (Raman) | 0.981957 |