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N-allyl-N'-(4-chlorophenyl)-N-[1-(4-ethylphenyl)-2,5-dioxo-3-pyrrolidinyl]thiourea
SpectraBase Compound ID A73BhKmtUsU
InChI InChI=1S/C22H22ClN3O2S/c1-3-13-25(22(29)24-17-9-7-16(23)8-10-17)19-14-20(27)26(21(19)28)18-11-5-15(4-2)6-12-18/h3,5-12,19H,1,4,13-14H2,2H3,(H,24,29)
InChIKey FJPSBQRLGHAQKI-UHFFFAOYSA-N
Mol Weight 427.95 g/mol
Molecular Formula C22H22ClN3O2S
Exact Mass 427.112126 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Iwi6Hj2LWrH
Name N-allyl-N'-(4-chlorophenyl)-N-[1-(4-ethylphenyl)-2,5-dioxo-3-pyrrolidinyl]thiourea
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/C22H22ClN3O2S/c1-3-13-25(22(29)24-17-9-7-16(23)8-10-17)19-14-20(27)26(21(19)28)18-11-5-15(4-2)6-12-18/h3,5-12,19H,1,4,13-14H2,2H3,(H,24,29)
InChIKey FJPSBQRLGHAQKI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1418
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: 9311894; UBI_ID: UBI-001419
Temperature 318 °C