![6-{[3-methyl-4-(4-methylphenyl)-1-piperazinyl]sulfonyl}-3,4-dihydro-2(1H)-quinolinone](/api/spectrum/9wl39hND3V2/structure.png?h=300&w=458 "6-{[3-methyl-4-(4-methylphenyl)-1-piperazinyl]sulfonyl}-3,4-dihydro-2(1H)-quinolinone")
| SpectraBase Compound ID | 6S2WpUrL5Uy |
|---|---|
| InChI | InChI=1S/C21H25N3O3S/c1-15-3-6-18(7-4-15)24-12-11-23(14-16(24)2)28(26,27)19-8-9-20-17(13-19)5-10-21(25)22-20/h3-4,6-9,13,16H,5,10-12,14H2,1-2H3,(H,22,25) |
| InChIKey | IKUDCCQQXGFBFL-UHFFFAOYSA-N |
| Mol Weight | 399.51 g/mol |
| Molecular Formula | C21H25N3O3S |
| Exact Mass | 399.161663 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 9wl39hND3V2 |
|---|---|
| Name | 6-{[3-methyl-4-(4-methylphenyl)-1-piperazinyl]sulfonyl}-3,4-dihydro-2(1H)-quinolinone |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 399.161662848 u |
| Formula | C21H25N3O3S |
| InChI | InChI=1S/C21H25N3O3S/c1-15-3-6-18(7-4-15)24-12-11-23(14-16(24)2)28(26,27)19-8-9-20-17(13-19)5-10-21(25)22-20/h3-4,6-9,13,16H,5,10-12,14H2,1-2H3,(H,22,25) |
| InChIKey | IKUDCCQQXGFBFL-UHFFFAOYSA-N |
| Molecular Weight | 399.509 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_2845 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12288089 |