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N'-(4-chlorophenyl)-N-(3-pyridinylmethyl)-N-[3-(trifluoromethyl)benzyl]urea
SpectraBase Compound ID GHEYR7GTzcW
InChI InChI=1S/C21H17ClF3N3O/c22-18-6-8-19(9-7-18)27-20(29)28(14-16-4-2-10-26-12-16)13-15-3-1-5-17(11-15)21(23,24)25/h1-12H,13-14H2,(H,27,29)
InChIKey KJVGJSWOLQNXFR-UHFFFAOYSA-N
Mol Weight 419.84 g/mol
Molecular Formula C21H17ClF3N3O
Exact Mass 419.101224 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9C0nAEc7Kge
Name N'-(4-chlorophenyl)-N-(3-pyridinylmethyl)-N-[3-(trifluoromethyl)benzyl]urea
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/C21H17ClF3N3O/c22-18-6-8-19(9-7-18)27-20(29)28(14-16-4-2-10-26-12-16)13-15-3-1-5-17(11-15)21(23,24)25/h1-12H,13-14H2,(H,27,29)
InChIKey KJVGJSWOLQNXFR-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7529_1789
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: NMR/9263733; Labnumber: PRO-PP01001
Temperature 303 °C