SpectraBase Compound ID | G8IGCrBfaOo |
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InChI | InChI=1S/C29H30N4O4/c1-20-9-13-22(14-10-20)18-30-26(34)8-5-17-32-28(36)24-6-3-4-7-25(24)33(29(32)37)19-27(35)31-23-15-11-21(2)12-16-23/h3-4,6-7,9-16H,5,8,17-19H2,1-2H3,(H,30,34)(H,31,35) |
InChIKey | MHQHTWBLMZZQDE-UHFFFAOYSA-N |
Mol Weight | 498.58 g/mol |
Molecular Formula | C29H30N4O4 |
Exact Mass | 498.226705 g/mol |
SpectraBase Spectrum ID | G6UpUTZue9x |
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Name | 4-(2,4-dioxo-1-[2-oxo-2-(4-toluidino)ethyl]-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 | 498.226705458 u |
Formula | C29H30N4O4 |
InChI | InChI=1S/C29H30N4O4/c1-20-9-13-22(14-10-20)18-30-26(34)8-5-17-32-28(36)24-6-3-4-7-25(24)33(29(32)37)19-27(35)31-23-15-11-21(2)12-16-23/h3-4,6-7,9-16H,5,8,17-19H2,1-2H3,(H,30,34)(H,31,35) |
InChIKey | MHQHTWBLMZZQDE-UHFFFAOYSA-N |
Molecular Weight | 498.583 g/mol |
NMR Offset | 18.0033 |
NMR Spectrometer Frequency | 500.136 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_9500 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/13229397 |