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3-[3-(4-bromo-2,6-dimethylphenoxy)propyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
SpectraBase Compound ID D8U2tqAalri
InChI InChI=1S/C26H25BrN2O3/c1-17-15-20(27)16-18(2)24(17)32-14-6-13-29-25(19-9-11-21(31-3)12-10-19)28-23-8-5-4-7-22(23)26(29)30/h4-5,7-12,15-16H,6,13-14H2,1-3H3
InChIKey IKCAKGXVVDQXOM-UHFFFAOYSA-N
Mol Weight 493.4 g/mol
Molecular Formula C26H25BrN2O3
Exact Mass 492.104856 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KpmSX8mneal
Name 3-[3-(4-bromo-2,6-dimethylphenoxy)propyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C26H25BrN2O3/c1-17-15-20(27)16-18(2)24(17)32-14-6-13-29-25(19-9-11-21(31-3)12-10-19)28-23-8-5-4-7-22(23)26(29)30/h4-5,7-12,15-16H,6,13-14H2,1-3H3
InChIKey IKCAKGXVVDQXOM-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21770
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D55731; Labnumber: RNOP4-0964; SBI_ID: SBI-021774
Temperature 315 °C