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N-allyl-N'-(3,4-dichlorophenyl)-N-[1-(4-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]thiourea
SpectraBase Compound ID FSZpioDNA2r
InChI InChI=1S/C21H19Cl2N3O2S/c1-3-10-25(21(29)24-14-6-9-16(22)17(23)11-14)18-12-19(27)26(20(18)28)15-7-4-13(2)5-8-15/h3-9,11,18H,1,10,12H2,2H3,(H,24,29)
InChIKey KVVWORSJOOSZOD-UHFFFAOYSA-N
Mol Weight 448.37 g/mol
Molecular Formula C21H19Cl2N3O2S
Exact Mass 447.057503 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5M4rBAmUnXO
Name N-allyl-N'-(3,4-dichlorophenyl)-N-[1-(4-methylphenyl)-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/C21H19Cl2N3O2S/c1-3-10-25(21(29)24-14-6-9-16(22)17(23)11-14)18-12-19(27)26(20(18)28)15-7-4-13(2)5-8-15/h3-9,11,18H,1,10,12H2,2H3,(H,24,29)
InChIKey KVVWORSJOOSZOD-UHFFFAOYSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1313
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: 9311816; UBI_ID: UBI-001314
Temperature 308 °C