For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-(1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)-N-(4-methylbenzyl)butanamide
SpectraBase Compound ID 8AU4XGRYTwA
InChI InChI=1S/C28H26BrFN4O4/c1-18-8-10-19(11-9-18)16-31-25(35)7-4-14-33-27(37)21-5-2-3-6-24(21)34(28(33)38)17-26(36)32-23-13-12-20(29)15-22(23)30/h2-3,5-6,8-13,15H,4,7,14,16-17H2,1H3,(H,31,35)(H,32,36)
InChIKey YRGDGMXDHVRDDD-UHFFFAOYSA-N
Mol Weight 581.44 g/mol
Molecular Formula C28H26BrFN4O4
Exact Mass 580.112146 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IlKgKIBJorQ
Name 4-(1-[2-(4-bromo-2-fluoroanilino)-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 580.112146492 u
Formula C28H26BrFN4O4
InChI InChI=1S/C28H26BrFN4O4/c1-18-8-10-19(11-9-18)16-31-25(35)7-4-14-33-27(37)21-5-2-3-6-24(21)34(28(33)38)17-26(36)32-23-13-12-20(29)15-22(23)30/h2-3,5-6,8-13,15H,4,7,14,16-17H2,1H3,(H,31,35)(H,32,36)
InChIKey YRGDGMXDHVRDDD-UHFFFAOYSA-N
Molecular Weight 581.442 g/mol
NMR Offset 18.0011
NMR Spectrometer Frequency 500.136
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9516
Solvent DMSO-d6
Source Vendor ID: NMR/13229413