SpectraBase Compound ID | BztS5tXIqj2 |
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InChI | InChI=1S/C18H21BrN2O3S2/c1-2-13-5-3-7-15(11-13)20-18(22)14-6-4-10-21(12-14)26(23,24)17-9-8-16(19)25-17/h3,5,7-9,11,14H,2,4,6,10,12H2,1H3,(H,20,22) |
InChIKey | OJRBVIZJZCOCIS-UHFFFAOYSA-N |
Mol Weight | 457.4 g/mol |
Molecular Formula | C18H21BrN2O3S2 |
Exact Mass | 456.017698 g/mol |
SpectraBase Spectrum ID | DgcIKivQEhM |
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Name | 1-[(5-bromo-2-thienyl)sulfonyl]-N-(3-ethylphenyl)-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 | 456.017697889 u |
Formula | C18H21BrN2O3S2 |
InChI | InChI=1S/C18H21BrN2O3S2/c1-2-13-5-3-7-15(11-13)20-18(22)14-6-4-10-21(12-14)26(23,24)17-9-8-16(19)25-17/h3,5,7-9,11,14H,2,4,6,10,12H2,1H3,(H,20,22) |
InChIKey | OJRBVIZJZCOCIS-UHFFFAOYSA-N |
Molecular Weight | 457.401 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_3049 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12288335 |