SpectraBase Compound ID | LLsceDyDJB6 |
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InChI | InChI=1S/C17H18Br2N2O3S2/c1-11-9-13(18)4-5-14(11)20-17(22)12-3-2-8-21(10-12)26(23,24)16-7-6-15(19)25-16/h4-7,9,12H,2-3,8,10H2,1H3,(H,20,22) |
InChIKey | AVQKJMGHMVBCSS-UHFFFAOYSA-N |
Mol Weight | 522.27 g/mol |
Molecular Formula | C17H18Br2N2O3S2 |
Exact Mass | 519.912561 g/mol |
SpectraBase Spectrum ID | HPAzpfGSegz |
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Name | N-(4-bromo-2-methylphenyl)-1-[(5-bromo-2-thienyl)sulfonyl]-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 | 519.912560793 u |
Formula | C17H18Br2N2O3S2 |
InChI | InChI=1S/C17H18Br2N2O3S2/c1-11-9-13(18)4-5-14(11)20-17(22)12-3-2-8-21(10-12)26(23,24)16-7-6-15(19)25-16/h4-7,9,12H,2-3,8,10H2,1H3,(H,20,22) |
InChIKey | AVQKJMGHMVBCSS-UHFFFAOYSA-N |
Molecular Weight | 522.270 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_3055 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12288344 |