![N-(2-chlorobenzyl)-4-(1-(2-{[2-(1-cyclohexen-1-yl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)butanamide](/api/spectrum/DfcBMTK5Vfj/structure.png?h=300&w=458 "N-(2-chlorobenzyl)-4-(1-(2-{[2-(1-cyclohexen-1-yl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)butanamide")
| SpectraBase Compound ID | 365bgEk1fLK |
|---|---|
| InChI | InChI=1S/C29H33ClN4O4/c30-24-13-6-4-11-22(24)19-32-26(35)15-8-18-33-28(37)23-12-5-7-14-25(23)34(29(33)38)20-27(36)31-17-16-21-9-2-1-3-10-21/h4-7,9,11-14H,1-3,8,10,15-20H2,(H,31,36)(H,32,35) |
| InChIKey | MKAJQGPVSVAHGA-UHFFFAOYSA-N |
| Mol Weight | 537.1 g/mol |
| Molecular Formula | C29H33ClN4O4 |
| Exact Mass | 536.219033 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | DfcBMTK5Vfj |
|---|---|
| Name | N-(2-chlorobenzyl)-4-(1-(2-{[2-(1-cyclohexen-1-yl)ethyl]amino}-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 | 536.219033255 u |
| Formula | C29H33ClN4O4 |
| InChI | InChI=1S/C29H33ClN4O4/c30-24-13-6-4-11-22(24)19-32-26(35)15-8-18-33-28(37)23-12-5-7-14-25(23)34(29(33)38)20-27(36)31-17-16-21-9-2-1-3-10-21/h4-7,9,11-14H,1-3,8,10,15-20H2,(H,31,36)(H,32,35) |
| InChIKey | MKAJQGPVSVAHGA-UHFFFAOYSA-N |
| Molecular Weight | 537.060 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_6466 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12328646 |