| SpectraBase Compound ID | CFND1rhWnOF |
|---|---|
| InChI | InChI=1S/C20H18N2O/c1-21-17-11-6-5-10-16(17)19(20(21)23)18-12-7-13-22(18)14-15-8-3-2-4-9-15/h2-13,19H,14H2,1H3 |
| InChIKey | VJYIXYVDYKAPSB-UHFFFAOYSA-N |
| Mol Weight | 302.38 g/mol |
| Molecular Formula | C20H18N2O |
| Exact Mass | 302.141913 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7vDSOOVDoMF |
|---|---|
| Name | 3-(1'-Benzyl-1H-pyrrol-2'-yl)-1-methyl-1,3-dihydroindol-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.141913207 u |
| Formula | C20H18N2O |
| InChI | InChI=1S/C20H18N2O/c1-21-17-11-6-5-10-16(17)19(20(21)23)18-12-7-13-22(18)14-15-8-3-2-4-9-15/h2-13,19H,14H2,1H3 |
| InChIKey | VJYIXYVDYKAPSB-UHFFFAOYSA-N |
| SMILES | C1(C(N(C)C2=C1C=CC=C2)=O)C=1N(C=CC1)CC=1C=CC=CC1 |