![N-(2-chlorobenzyl)-4-(1-[2-(2,4-difluoroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)butanamide](/api/spectrum/5krEwCG9wVQ/structure.png?h=300&w=458 "N-(2-chlorobenzyl)-4-(1-[2-(2,4-difluoroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)butanamide")
| SpectraBase Compound ID | 4nkDSktEpIt |
|---|---|
| InChI | InChI=1S/C27H23ClF2N4O4/c28-20-8-3-1-6-17(20)15-31-24(35)10-5-13-33-26(37)19-7-2-4-9-23(19)34(27(33)38)16-25(36)32-22-12-11-18(29)14-21(22)30/h1-4,6-9,11-12,14H,5,10,13,15-16H2,(H,31,35)(H,32,36) |
| InChIKey | IWOYEYYEFARRDD-UHFFFAOYSA-N |
| Mol Weight | 540.95 g/mol |
| Molecular Formula | C27H23ClF2N4O4 |
| Exact Mass | 540.137589 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 5krEwCG9wVQ |
|---|---|
| Name | N-(2-chlorobenzyl)-4-(1-[2-(2,4-difluoroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)butanamide |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 540.137589259 u |
| Formula | C27H23ClF2N4O4 |
| InChI | InChI=1S/C27H23ClF2N4O4/c28-20-8-3-1-6-17(20)15-31-24(35)10-5-13-33-26(37)19-7-2-4-9-23(19)34(27(33)38)16-25(36)32-22-12-11-18(29)14-21(22)30/h1-4,6-9,11-12,14H,5,10,13,15-16H2,(H,31,35)(H,32,36) |
| InChIKey | IWOYEYYEFARRDD-UHFFFAOYSA-N |
| Molecular Weight | 540.955 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_7477 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/13218272 |