![5-bromo-2-[(p-chlorophenoxy)methyl]-3-[(1-pyrrolidinyl)methyl]benzo[b]thiophene](/api/spectrum/4mnzCmuW2qA/structure.png?h=300&w=458 "5-bromo-2-[(p-chlorophenoxy)methyl]-3-[(1-pyrrolidinyl)methyl]benzo[b]thiophene")
| SpectraBase Compound ID | HMNZXruNG6Q |
|---|---|
| InChI | InChI=1S/C20H19BrClNOS/c21-14-3-8-19-17(11-14)18(12-23-9-1-2-10-23)20(25-19)13-24-16-6-4-15(22)5-7-16/h3-8,11H,1-2,9-10,12-13H2 |
| InChIKey | JVJVGOYKEVBOCW-UHFFFAOYSA-N |
| Mol Weight | 436.8 g/mol |
| Molecular Formula | C20H19BrClNOS |
| Exact Mass | 435.005926 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4mnzCmuW2qA |
|---|---|
| Name | 5-bromo-2-[(p-chlorophenoxy)methyl]-3-[(1-pyrrolidinyl)methyl]benzo[b]thiophene |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H19BrClNOS |
| InChI | InChI=1S/C20H19BrClNOS/c21-14-3-8-19-17(11-14)18(12-23-9-1-2-10-23)20(25-19)13-24-16-6-4-15(22)5-7-16/h3-8,11H,1-2,9-10,12-13H2 |
| InChIKey | JVJVGOYKEVBOCW-UHFFFAOYSA-N |
| Instrument Name | Varian A-60D |
| Sadtler NMR Number | 18640M |
| Solvent | Polysol |