| SpectraBase Compound ID | 1HpiOjCIZjv |
|---|---|
| InChI | InChI=1S/C22H23NO/c1-3-4-15-23-17(2)16-20(21(23)18-11-7-5-8-12-18)22(24)19-13-9-6-10-14-19/h5-14,16H,3-4,15H2,1-2H3 |
| InChIKey | FVLVKLDAHWTPHH-UHFFFAOYSA-N |
| Mol Weight | 317.43 g/mol |
| Molecular Formula | C22H23NO |
| Exact Mass | 317.177964 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HMdux733KhH |
|---|---|
| Name | 3-Benzoyl-1-butyl-5-methyl-2-phenylpyrrole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 317.177964364 u |
| Formula | C22H23NO |
| InChI | InChI=1S/C22H23NO/c1-3-4-15-23-17(2)16-20(21(23)18-11-7-5-8-12-18)22(24)19-13-9-6-10-14-19/h5-14,16H,3-4,15H2,1-2H3 |
| InChIKey | FVLVKLDAHWTPHH-UHFFFAOYSA-N |
| Molecular Weight | 317.432 g/mol |
| SMILES | C1(=C(N(CCCC)C(=C1)C)C1=CC=CC=C1)C(=O)C1=CC=CC=C1 |