SpectraBase Compound ID | 93UO9Opfd3g |
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InChI | InChI=1S/C31H34N4O4/c1-20-11-13-24(14-12-20)18-32-27(36)10-7-15-34-30(38)25-8-5-6-9-26(25)35(31(34)39)19-28(37)33-29-22(3)16-21(2)17-23(29)4/h5-6,8-9,11-14,16-17H,7,10,15,18-19H2,1-4H3,(H,32,36)(H,33,37) |
InChIKey | NBVPDSCYUHJEDC-UHFFFAOYSA-N |
Mol Weight | 526.6 g/mol |
Molecular Formula | C31H34N4O4 |
Exact Mass | 526.258006 g/mol |
SpectraBase Spectrum ID | 7Bl6pOHim3D |
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Name | 4-(1-[2-(mesitylamino)-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 | 526.258005587 u |
Formula | C31H34N4O4 |
InChI | InChI=1S/C31H34N4O4/c1-20-11-13-24(14-12-20)18-32-27(36)10-7-15-34-30(38)25-8-5-6-9-26(25)35(31(34)39)19-28(37)33-29-22(3)16-21(2)17-23(29)4/h5-6,8-9,11-14,16-17H,7,10,15,18-19H2,1-4H3,(H,32,36)(H,33,37) |
InChIKey | NBVPDSCYUHJEDC-UHFFFAOYSA-N |
Molecular Weight | 526.637 g/mol |
NMR Offset | 17.9985 |
NMR Spectrometer Frequency | 500.136 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_9517 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/13229416 |