SpectraBase Compound ID | Kl0lQdmT78Y |
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InChI | InChI=1S/C20H25BrN2O5S2/c1-27-16-6-5-14(12-17(16)28-2)9-10-22-20(24)15-4-3-11-23(13-15)30(25,26)19-8-7-18(21)29-19/h5-8,12,15H,3-4,9-11,13H2,1-2H3,(H,22,24) |
InChIKey | FFXCWGLVENNPMF-UHFFFAOYSA-N |
Mol Weight | 517.45 g/mol |
Molecular Formula | C20H25BrN2O5S2 |
Exact Mass | 516.038827 g/mol |
SpectraBase Spectrum ID | 1BaL7gNrit7 |
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Name | 1-[(5-bromo-2-thienyl)sulfonyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-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 | 516.038827256 u |
Formula | C20H25BrN2O5S2 |
InChI | InChI=1S/C20H25BrN2O5S2/c1-27-16-6-5-14(12-17(16)28-2)9-10-22-20(24)15-4-3-11-23(13-15)30(25,26)19-8-7-18(21)29-19/h5-8,12,15H,3-4,9-11,13H2,1-2H3,(H,22,24) |
InChIKey | FFXCWGLVENNPMF-UHFFFAOYSA-N |
Molecular Weight | 517.453 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_3029 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12288313 |