![3-(1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)-N-cyclopentylpropanamide](/api/spectrum/9nnGKtI1vV/structure.png?h=300&w=458 "3-(1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)-N-cyclopentylpropanamide")
| SpectraBase Compound ID | 3sWpiyvYOg8 |
|---|---|
| InChI | InChI=1S/C24H24BrFN4O4/c25-15-9-10-19(18(26)13-15)28-22(32)14-30-20-8-4-3-7-17(20)23(33)29(24(30)34)12-11-21(31)27-16-5-1-2-6-16/h3-4,7-10,13,16H,1-2,5-6,11-12,14H2,(H,27,31)(H,28,32) |
| InChIKey | FXBCQVQRKJVXEU-UHFFFAOYSA-N |
| Mol Weight | 531.38 g/mol |
| Molecular Formula | C24H24BrFN4O4 |
| Exact Mass | 530.096496 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 9nnGKtI1vV |
|---|---|
| Name | 3-(1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)-N-cyclopentylpropanamide |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 530.096496428 u |
| Formula | C24H24BrFN4O4 |
| InChI | InChI=1S/C24H24BrFN4O4/c25-15-9-10-19(18(26)13-15)28-22(32)14-30-20-8-4-3-7-17(20)23(33)29(24(30)34)12-11-21(31)27-16-5-1-2-6-16/h3-4,7-10,13,16H,1-2,5-6,11-12,14H2,(H,27,31)(H,28,32) |
| InChIKey | FXBCQVQRKJVXEU-UHFFFAOYSA-N |
| Molecular Weight | 531.382 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_6059 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12328094 |