![4-(1-[2-(2-fluoroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)-N-[2-(4-methylphenyl)ethyl]butanamide](/api/spectrum/FgsonHAC4lr/structure.png?h=300&w=458 "4-(1-[2-(2-fluoroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)-N-[2-(4-methylphenyl)ethyl]butanamide")
| SpectraBase Compound ID | 3Pse9QhWn3l |
|---|---|
| InChI | InChI=1S/C29H29FN4O4/c1-20-12-14-21(15-13-20)16-17-31-26(35)11-6-18-33-28(37)22-7-2-5-10-25(22)34(29(33)38)19-27(36)32-24-9-4-3-8-23(24)30/h2-5,7-10,12-15H,6,11,16-19H2,1H3,(H,31,35)(H,32,36) |
| InChIKey | UANUWAKVRNDZFW-UHFFFAOYSA-N |
| Mol Weight | 516.57 g/mol |
| Molecular Formula | C29H29FN4O4 |
| Exact Mass | 516.217284 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | FgsonHAC4lr |
|---|---|
| Name | 4-(1-[2-(2-fluoroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)-N-[2-(4-methylphenyl)ethyl]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 | 516.217283589 u |
| Formula | C29H29FN4O4 |
| InChI | InChI=1S/C29H29FN4O4/c1-20-12-14-21(15-13-20)16-17-31-26(35)11-6-18-33-28(37)22-7-2-5-10-25(22)34(29(33)38)19-27(36)32-24-9-4-3-8-23(24)30/h2-5,7-10,12-15H,6,11,16-19H2,1H3,(H,31,35)(H,32,36) |
| InChIKey | UANUWAKVRNDZFW-UHFFFAOYSA-N |
| Molecular Weight | 516.573 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_6050 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12328084 |