SpectraBase Compound ID | ELXMBhvznqd |
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InChI | InChI=1S/C27H26N4O5/c1-19-11-13-20(14-12-19)17-28-25(32)10-5-15-29-26(33)23-8-2-3-9-24(23)30(27(29)34)18-21-6-4-7-22(16-21)31(35)36/h2-4,6-9,11-14,16H,5,10,15,17-18H2,1H3,(H,28,32) |
InChIKey | QOXKYLYNOUYEIA-UHFFFAOYSA-N |
Mol Weight | 486.53 g/mol |
Molecular Formula | C27H26N4O5 |
Exact Mass | 486.19032 g/mol |
SpectraBase Spectrum ID | G91lb48QEv |
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Name | N-(4-methylbenzyl)-4-(1-(3-nitrobenzyl)-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 | 486.190319948 u |
Formula | C27H26N4O5 |
InChI | InChI=1S/C27H26N4O5/c1-19-11-13-20(14-12-19)17-28-25(32)10-5-15-29-26(33)23-8-2-3-9-24(23)30(27(29)34)18-21-6-4-7-22(16-21)31(35)36/h2-4,6-9,11-14,16H,5,10,15,17-18H2,1H3,(H,28,32) |
InChIKey | QOXKYLYNOUYEIA-UHFFFAOYSA-N |
Molecular Weight | 486.528 g/mol |
NMR Offset | 18.0012 |
NMR Spectrometer Frequency | 500.136 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_9485 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/13229382 |