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1-{4-[4-(Allyloxy)-3-methoxyphenyl]-6-phenyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinyl}ethanone
SpectraBase Compound ID D8qRX17gXCK
InChI InChI=1S/C22H22N2O3S/c1-4-12-27-17-11-10-16(13-18(17)26-3)21-19(14(2)25)20(23-22(28)24-21)15-8-6-5-7-9-15/h4-11,13,21H,1,12H2,2-3H3,(H2,23,24,28)
InChIKey ARJQWGDGOORFME-UHFFFAOYSA-N
Mol Weight 394.49 g/mol
Molecular Formula C22H22N2O3S
Exact Mass 394.135114 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5Ov0bCZ6Y3G
Name 1-{4-[4-(allyloxy)-3-methoxyphenyl]-6-phenyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinyl}ethanone
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C22H22N2O3S/c1-4-12-27-17-11-10-16(13-18(17)26-3)21-19(14(2)25)20(23-22(28)24-21)15-8-6-5-7-9-15/h4-11,13,21H,1,12H2,2-3H3,(H2,23,24,28)
InChIKey ARJQWGDGOORFME-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34795
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: 9381990; SBI_ID: SBI-034799
Temperature 318 °C