| SpectraBase Compound ID | B8ireELTt1V |
|---|---|
| InChI | InChI=1S/C27H25ClFN3O3/c1-18-8-10-19(11-9-18)16-30-25(33)7-4-14-31-26(34)22-5-2-3-6-24(22)32(27(31)35)17-20-12-13-21(29)15-23(20)28/h2-3,5-6,8-13,15H,4,7,14,16-17H2,1H3,(H,30,33) |
| InChIKey | YHRHGTHUHMNMHZ-UHFFFAOYSA-N |
| Mol Weight | 493.97 g/mol |
| Molecular Formula | C27H25ClFN3O3 |
| Exact Mass | 493.156848 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 9S6wbag0fNv |
|---|---|
| Name | 4-(1-(2-chloro-4-fluorobenzyl)-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)-N-(4-methylbenzyl)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 | 493.156847537 u |
| Formula | C27H25ClFN3O3 |
| InChI | InChI=1S/C27H25ClFN3O3/c1-18-8-10-19(11-9-18)16-30-25(33)7-4-14-31-26(34)22-5-2-3-6-24(22)32(27(31)35)17-20-12-13-21(29)15-23(20)28/h2-3,5-6,8-13,15H,4,7,14,16-17H2,1H3,(H,30,33) |
| InChIKey | YHRHGTHUHMNMHZ-UHFFFAOYSA-N |
| Molecular Weight | 493.966 g/mol |
| NMR Offset | 18.0007 |
| NMR Spectrometer Frequency | 500.136 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_9509 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/13229406 |