SpectraBase Compound ID | GvRTqAU397M |
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InChI | InChI=1S/C23H24ClN3O5S/c1-31-19-13-20(32-2)18(12-17(19)24)26-23(28)16-8-5-11-27(14-16)33(29,30)21-9-3-6-15-7-4-10-25-22(15)21/h3-4,6-7,9-10,12-13,16H,5,8,11,14H2,1-2H3,(H,26,28) |
InChIKey | QSKCHSNINBBUSC-UHFFFAOYSA-N |
Mol Weight | 489.97 g/mol |
Molecular Formula | C23H24ClN3O5S |
Exact Mass | 489.11252 g/mol |
SpectraBase Spectrum ID | 7ulRYBvVSA0 |
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Name | 3-piperidinecarboxamide, N-(5-chloro-2,4-dimethoxyphenyl)-1-(8-quinolinylsulfonyl)- |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 489.112519754 u |
Formula | C23H24ClN3O5S |
InChI | InChI=1S/C23H24ClN3O5S/c1-31-19-13-20(32-2)18(12-17(19)24)26-23(28)16-8-5-11-27(14-16)33(29,30)21-9-3-6-15-7-4-10-25-22(15)21/h3-4,6-7,9-10,12-13,16H,5,8,11,14H2,1-2H3,(H,26,28) |
InChIKey | QSKCHSNINBBUSC-UHFFFAOYSA-N |
Molecular Weight | 489.974 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2021_3233 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/13278428 |