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3-[3-(2-tert-butyl-4-methylphenoxy)propyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
SpectraBase Compound ID Cw0dQXI2UH5
InChI InChI=1S/C29H32N2O3/c1-20-11-16-26(24(19-20)29(2,3)4)34-18-8-17-31-27(21-12-14-22(33-5)15-13-21)30-25-10-7-6-9-23(25)28(31)32/h6-7,9-16,19H,8,17-18H2,1-5H3
InChIKey ZZXDEQNGBBZFSN-UHFFFAOYSA-N
Mol Weight 456.6 g/mol
Molecular Formula C29H32N2O3
Exact Mass 456.241293 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3neRuu2ByVK
Name 3-[3-(2-tert-butyl-4-methylphenoxy)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/C29H32N2O3/c1-20-11-16-26(24(19-20)29(2,3)4)34-18-8-17-31-27(21-12-14-22(33-5)15-13-21)30-25-10-7-6-9-23(25)28(31)32/h6-7,9-16,19H,8,17-18H2,1-5H3
InChIKey ZZXDEQNGBBZFSN-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27615
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: D77282; Labnumber: RNOP4-0870; SBI_ID: SBI-027619
Temperature 308 °C