| SpectraBase Compound ID | LJs754IpUxR |
|---|---|
| InChI | InChI=1S/C25H28ClN3O3/c26-21-13-5-1-9-18(21)17-29-22-14-6-4-12-20(22)24(31)28(25(29)32)16-8-7-15-23(30)27-19-10-2-3-11-19/h1,4-6,9,12-14,19H,2-3,7-8,10-11,15-17H2,(H,27,30) |
| InChIKey | BAEOJOVQGZWLJK-UHFFFAOYSA-N |
| Mol Weight | 453.97 g/mol |
| Molecular Formula | C25H28ClN3O3 |
| Exact Mass | 453.181919 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 8gToXO4UWGp |
|---|---|
| Name | 5-(1-(2-chlorobenzyl)-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)-N-cyclopentylpentanamide |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 453.181919471 u |
| Formula | C25H28ClN3O3 |
| InChI | InChI=1S/C25H28ClN3O3/c26-21-13-5-1-9-18(21)17-29-22-14-6-4-12-20(22)24(31)28(25(29)32)16-8-7-15-23(30)27-19-10-2-3-11-19/h1,4-6,9,12-14,19H,2-3,7-8,10-11,15-17H2,(H,27,30) |
| InChIKey | BAEOJOVQGZWLJK-UHFFFAOYSA-N |
| Molecular Weight | 453.970 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_6797 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12329211 |