| SpectraBase Compound ID | 6oPWFg46N2D |
|---|---|
| InChI | InChI=1S/C16H16N2/c17-10-14(12-6-2-1-3-7-12)15-11-18-16-9-5-4-8-13(15)16/h1-9,11,14,18H,10,17H2 |
| InChIKey | HEBVBIGUNHPPLF-UHFFFAOYSA-N |
| Mol Weight | 236.32 g/mol |
| Molecular Formula | C16H16N2 |
| Exact Mass | 236.131349 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AOyYshQugGM |
|---|---|
| Name | 2-(1H-Indol-3-yl)-2-phenylethylamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.131348523 u |
| Formula | C16H16N2 |
| InChI | InChI=1S/C16H16N2/c17-10-14(12-6-2-1-3-7-12)15-11-18-16-9-5-4-8-13(15)16/h1-9,11,14,18H,10,17H2 |
| InChIKey | HEBVBIGUNHPPLF-UHFFFAOYSA-N |
| Molecular Weight | 236.318 g/mol |
| SMILES | C1(=CNC2=C1C=CC=C2)C(C=1C=CC=CC1)CN |