| SpectraBase Compound ID | 6rULfSkKs4S |
|---|---|
| InChI | InChI=1S/C13H13NO/c1-3-6-13(15)12-9-10-7-4-5-8-11(10)14(12)2/h3-5,7-9H,1,6H2,2H3 |
| InChIKey | KPJOJQWNCTWMGY-UHFFFAOYSA-N |
| Mol Weight | 199.25 g/mol |
| Molecular Formula | C13H13NO |
| Exact Mass | 199.099714 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BASFdAZqSiY |
|---|---|
| Name | 4-(1'-Methyl-1H-indol-2'-yl)prop-2-en-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 199.099714042 u |
| Formula | C13H13NO |
| InChI | InChI=1S/C13H13NO/c1-3-6-13(15)12-9-10-7-4-5-8-11(10)14(12)2/h3-5,7-9H,1,6H2,2H3 |
| InChIKey | KPJOJQWNCTWMGY-UHFFFAOYSA-N |
| Molecular Weight | 199.253 g/mol |
| SMILES | C=1(N(C2=C(C1)C=CC=C2)C)C(=O)CC=C |