| SpectraBase Compound ID | 70iCI12L9xq |
|---|---|
| InChI | InChI=1S/C18H17NO2/c1-3-21-18(20)16-14-11-12(2)9-10-15(14)19-17(16)13-7-5-4-6-8-13/h4-11,19H,3H2,1-2H3 |
| InChIKey | ZEKVRPCUQXXXFA-UHFFFAOYSA-N |
| Mol Weight | 279.34 g/mol |
| Molecular Formula | C18H17NO2 |
| Exact Mass | 279.125929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | IQu5BZaOu0U |
|---|---|
| Name | Ethyl 5-methyl-2-phenyl-1H-indole-3-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.125928789 u |
| Formula | C18H17NO2 |
| InChI | InChI=1S/C18H17NO2/c1-3-21-18(20)16-14-11-12(2)9-10-15(14)19-17(16)13-7-5-4-6-8-13/h4-11,19H,3H2,1-2H3 |
| InChIKey | ZEKVRPCUQXXXFA-UHFFFAOYSA-N |
| Molecular Weight | 279.339 g/mol |
| SMILES | C=1(NC2=C(C1C(=O)OCC)C=C(C=C2)C)C1=CC=CC=C1 |