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N'-(3-methylphenyl)-N-[1-(4-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]-N-(2-phenylethyl)thiourea
SpectraBase Compound ID AqYkTHBDADt
InChI InChI=1S/C27H27N3O2S/c1-19-11-13-23(14-12-19)30-25(31)18-24(26(30)32)29(16-15-21-8-4-3-5-9-21)27(33)28-22-10-6-7-20(2)17-22/h3-14,17,24H,15-16,18H2,1-2H3,(H,28,33)
InChIKey LQXKKQHDJNENOJ-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 6yDrzs4htvl
Name N'-(3-methylphenyl)-N-[1-(4-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]-N-(2-phenylethyl)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/C27H27N3O2S/c1-19-11-13-23(14-12-19)30-25(31)18-24(26(30)32)29(16-15-21-8-4-3-5-9-21)27(33)28-22-10-6-7-20(2)17-22/h3-14,17,24H,15-16,18H2,1-2H3,(H,28,33)
InChIKey LQXKKQHDJNENOJ-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1421
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: 9311296; UBI_ID: UBI-001422
Temperature 308 °C