![N-benzyl-4-[(1-(2-{[2-(1-cyclohexen-1-yl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)methyl]cyclohexanecarboxamide](/api/spectrum/JJOrmF2eXSf/structure.png?h=300&w=458 "N-benzyl-4-[(1-(2-{[2-(1-cyclohexen-1-yl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)methyl]cyclohexanecarboxamide")
| SpectraBase Compound ID | KyY8mNHvhif |
|---|---|
| InChI | InChI=1S/C33H40N4O4/c38-30(34-20-19-24-9-3-1-4-10-24)23-36-29-14-8-7-13-28(29)32(40)37(33(36)41)22-26-15-17-27(18-16-26)31(39)35-21-25-11-5-2-6-12-25/h2,5-9,11-14,26-27H,1,3-4,10,15-23H2,(H,34,38)(H,35,39) |
| InChIKey | SQKCGJBZFCCVJL-UHFFFAOYSA-N |
| Mol Weight | 556.7 g/mol |
| Molecular Formula | C33H40N4O4 |
| Exact Mass | 556.304956 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | JJOrmF2eXSf |
|---|---|
| Name | N-benzyl-4-[(1-(2-{[2-(1-cyclohexen-1-yl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)methyl]cyclohexanecarboxamide |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 556.304955780 u |
| Formula | C33H40N4O4 |
| InChI | InChI=1S/C33H40N4O4/c38-30(34-20-19-24-9-3-1-4-10-24)23-36-29-14-8-7-13-28(29)32(40)37(33(36)41)22-26-15-17-27(18-16-26)31(39)35-21-25-11-5-2-6-12-25/h2,5-9,11-14,26-27H,1,3-4,10,15-23H2,(H,34,38)(H,35,39) |
| InChIKey | SQKCGJBZFCCVJL-UHFFFAOYSA-N |
| Molecular Weight | 556.707 g/mol |
| NMR Offset | 18.0148 |
| NMR Spectrometer Frequency | 500.136 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_9387 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/13229261 |