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4-[2-(benzyloxy)phenyl]-N-(4-ethylphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide
SpectraBase Compound ID 8hxtDB97Phs
InChI InChI=1S/C27H27N3O2S/c1-3-19-13-15-21(16-14-19)29-26(31)24-18(2)28-27(33)30-25(24)22-11-7-8-12-23(22)32-17-20-9-5-4-6-10-20/h4-16,25H,3,17H2,1-2H3,(H,29,31)(H2,28,30,33)
InChIKey CEAIFRAJZUSDLK-UHFFFAOYSA-N
Mol Weight 457.59 g/mol
Molecular Formula C27H27N3O2S
Exact Mass 457.182398 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6i3CdasViSg
Name 4-[2-(benzyloxy)phenyl]-N-(4-ethylphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide
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/C27H27N3O2S/c1-3-19-13-15-21(16-14-19)29-26(31)24-18(2)28-27(33)30-25(24)22-11-7-8-12-23(22)32-17-20-9-5-4-6-10-20/h4-16,25H,3,17H2,1-2H3,(H,29,31)(H2,28,30,33)
InChIKey CEAIFRAJZUSDLK-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_32120
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: 1844607; SBI_ID: SBI-032124
Temperature 315 °C