SpectraBase Compound ID | AODHMnRKr1H |
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InChI | InChI=1S/C27H32N4O4/c1-19-12-14-20(15-13-19)17-28-24(32)11-6-16-30-26(34)22-9-4-5-10-23(22)31(27(30)35)18-25(33)29-21-7-2-3-8-21/h4-5,9-10,12-15,21H,2-3,6-8,11,16-18H2,1H3,(H,28,32)(H,29,33) |
InChIKey | CWUOCGISXDEUBM-UHFFFAOYSA-N |
Mol Weight | 476.6 g/mol |
Molecular Formula | C27H32N4O4 |
Exact Mass | 476.242356 g/mol |
SpectraBase Spectrum ID | 6mnO4BT1LKY |
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Name | 4-(1-[2-(cyclopentylamino)-2-oxoethyl]-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 | 476.242355522 u |
Formula | C27H32N4O4 |
InChI | InChI=1S/C27H32N4O4/c1-19-12-14-20(15-13-19)17-28-24(32)11-6-16-30-26(34)22-9-4-5-10-23(22)31(27(30)35)18-25(33)29-21-7-2-3-8-21/h4-5,9-10,12-15,21H,2-3,6-8,11,16-18H2,1H3,(H,28,32)(H,29,33) |
InChIKey | CWUOCGISXDEUBM-UHFFFAOYSA-N |
Molecular Weight | 476.577 g/mol |
NMR Offset | 18.0002 |
NMR Spectrometer Frequency | 500.136 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_9505 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/13229402 |