| SpectraBase Compound ID | JdXDBbmgdAO |
|---|---|
| InChI | InChI=1S/C17H23NO/c1-3-4-5-6-8-15-9-7-14-18(15)16-10-12-17(19-2)13-11-16/h7,9-14H,3-6,8H2,1-2H3 |
| InChIKey | RUFMSEXFMSFYCM-UHFFFAOYSA-N |
| Mol Weight | 257.38 g/mol |
| Molecular Formula | C17H23NO |
| Exact Mass | 257.177964 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6bfrtv9UVgs |
|---|---|
| Name | 2-N-Hexyl-1-(4-methoxylphenyl)-1H-pyrrole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 257.177964364 u |
| Formula | C17H23NO |
| InChI | InChI=1S/C17H23NO/c1-3-4-5-6-8-15-9-7-14-18(15)16-10-12-17(19-2)13-11-16/h7,9-14H,3-6,8H2,1-2H3 |
| InChIKey | RUFMSEXFMSFYCM-UHFFFAOYSA-N |
| Molecular Weight | 257.377 g/mol |
| SMILES | C=1(N2C=CC=C2CCCCCC)C=CC(=CC1)OC |