![N-[3-(3,4-dihydro-2(1H)-isoquinolinyl)propyl]-1-(2-thienylsulfonyl)-3-piperidinecarboxamide](/api/spectrum/97qELS7U8Ki/structure.png?h=300&w=458 "N-[3-(3,4-dihydro-2(1H)-isoquinolinyl)propyl]-1-(2-thienylsulfonyl)-3-piperidinecarboxamide")
| SpectraBase Compound ID | HHiePwS6MKZ |
|---|---|
| InChI | InChI=1S/C22H29N3O3S2/c26-22(20-8-3-13-25(17-20)30(27,28)21-9-4-15-29-21)23-11-5-12-24-14-10-18-6-1-2-7-19(18)16-24/h1-2,4,6-7,9,15,20H,3,5,8,10-14,16-17H2,(H,23,26) |
| InChIKey | AFQIXNUFQUBINV-UHFFFAOYSA-N |
| Mol Weight | 447.61 g/mol |
| Molecular Formula | C22H29N3O3S2 |
| Exact Mass | 447.165034 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 97qELS7U8Ki |
|---|---|
| Name | N-[3-(3,4-dihydro-2(1H)-isoquinolinyl)propyl]-1-(2-thienylsulfonyl)-3-piperidinecarboxamide |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 447.165034151 u |
| Formula | C22H29N3O3S2 |
| InChI | InChI=1S/C22H29N3O3S2/c26-22(20-8-3-13-25(17-20)30(27,28)21-9-4-15-29-21)23-11-5-12-24-14-10-18-6-1-2-7-19(18)16-24/h1-2,4,6-7,9,15,20H,3,5,8,10-14,16-17H2,(H,23,26) |
| InChIKey | AFQIXNUFQUBINV-UHFFFAOYSA-N |
| Molecular Weight | 447.612 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_3080 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12288377 |