| SpectraBase Compound ID | BSXCKGA3Ih |
|---|---|
| InChI | InChI=1S/C21H22ClN3O3/c1-2-24(14-15-7-4-3-5-8-15)19(26)9-6-12-25-20(27)17-11-10-16(22)13-18(17)23-21(25)28/h3-5,7-8,10-11,13H,2,6,9,12,14H2,1H3,(H,23,28) |
| InChIKey | WBYPYADJLJRDMQ-UHFFFAOYSA-N |
| Mol Weight | 399.88 g/mol |
| Molecular Formula | C21H22ClN3O3 |
| Exact Mass | 399.134969 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | JNRu56SLKtq |
|---|---|
| Name | N-benzyl-4-(7-chloro-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)-N-ethylbutanamide |
| Copyright | Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 399.134969277 u |
| Formula | C21H22ClN3O3 |
| InChI | InChI=1S/C21H22ClN3O3/c1-2-24(14-15-7-4-3-5-8-15)19(26)9-6-12-25-20(27)17-11-10-16(22)13-18(17)23-21(25)28/h3-5,7-8,10-11,13H,2,6,9,12,14H2,1H3,(H,23,28) |
| InChIKey | WBYPYADJLJRDMQ-UHFFFAOYSA-N |
| Molecular Weight | 399.878 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_6444 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12328622 |