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3-[3-(4-tert-butyl-2-methylphenoxy)propyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
SpectraBase Compound ID 96ffJlvj4Zy
InChI InChI=1S/C29H32N2O3/c1-20-19-22(29(2,3)4)13-16-26(20)34-18-8-17-31-27(21-11-14-23(33-5)15-12-21)30-25-10-7-6-9-24(25)28(31)32/h6-7,9-16,19H,8,17-18H2,1-5H3
InChIKey WHUXJIJQIWJIHK-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 9kRKbOnyTxa
Name 3-[3-(4-tert-butyl-2-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/c1-20-19-22(29(2,3)4)13-16-26(20)34-18-8-17-31-27(21-11-14-23(33-5)15-12-21)30-25-10-7-6-9-24(25)28(31)32/h6-7,9-16,19H,8,17-18H2,1-5H3
InChIKey WHUXJIJQIWJIHK-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_12195
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: D59798; Labnumber: RNOP4-0726; SBI_ID: SBI-012198
Temperature 315 °C