![1-(2,3-dimethylphenyl)-4-{[1-(2-thienylsulfonyl)-3-piperidinyl]carbonyl}piperazine](/api/spectrum/7p0afkIwmt5/structure.png?h=300&w=458 "1-(2,3-dimethylphenyl)-4-{[1-(2-thienylsulfonyl)-3-piperidinyl]carbonyl}piperazine")
| SpectraBase Compound ID | C81lBHCq7Wl |
|---|---|
| InChI | InChI=1S/C22H29N3O3S2/c1-17-6-3-8-20(18(17)2)23-11-13-24(14-12-23)22(26)19-7-4-10-25(16-19)30(27,28)21-9-5-15-29-21/h3,5-6,8-9,15,19H,4,7,10-14,16H2,1-2H3 |
| InChIKey | DBVSVMYKVFRCEJ-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 | 7p0afkIwmt5 |
|---|---|
| Name | 1-(2,3-dimethylphenyl)-4-{[1-(2-thienylsulfonyl)-3-piperidinyl]carbonyl}piperazine |
| 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/c1-17-6-3-8-20(18(17)2)23-11-13-24(14-12-23)22(26)19-7-4-10-25(16-19)30(27,28)21-9-5-15-29-21/h3,5-6,8-9,15,19H,4,7,10-14,16H2,1-2H3 |
| InChIKey | DBVSVMYKVFRCEJ-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_2934 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12288214 |