| SpectraBase Compound ID | fT5rHW6Osl |
|---|---|
| InChI | InChI=1S/C17H15NO2/c1-2-20-17(19)13-9-7-12(8-10-13)15-11-18-16-6-4-3-5-14(15)16/h3-11,18H,2H2,1H3 |
| InChIKey | YQLUNZBSPBTVNS-UHFFFAOYSA-N |
| Mol Weight | 265.31 g/mol |
| Molecular Formula | C17H15NO2 |
| Exact Mass | 265.110279 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GyfuyLvxHgC |
|---|---|
| Name | 4-(1H-Indol-3-yl)benzoic acid ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 265.110278725 u |
| Formula | C17H15NO2 |
| InChI | InChI=1S/C17H15NO2/c1-2-20-17(19)13-9-7-12(8-10-13)15-11-18-16-6-4-3-5-14(15)16/h3-11,18H,2H2,1H3 |
| InChIKey | YQLUNZBSPBTVNS-UHFFFAOYSA-N |
| Molecular Weight | 265.312 g/mol |
| SMILES | C(C=1C=CC(=CC1)C1=CNC2=C1C=CC=C2)(=O)OCC |