N-(1,3-benzodioxol-5-ylmethyl)-N-(4-fluorophenyl)-N'-[2,2,2-trifluoro-1-methyl-1-(trifluoromethyl)ethyl]urea

SpectraBase Compound ID	5JucizjLJS2
InChI	InChI=1S/C19H15F7N2O3/c1-17(18(21,22)23,19(24,25)26)27-16(29)28(13-5-3-12(20)4-6-13)9-11-2-7-14-15(8-11)31-10-30-14/h2-8H,9-10H2,1H3,(H,27,29)
InChIKey	WZEZUSKJFUQOGS-UHFFFAOYSA-N Google Search
Mol Weight	452.33 g/mol
Molecular Formula	C19H15F7N2O3
Exact Mass	452.097089 g/mol

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SpectraBase Spectrum ID	3ikR5zGnM11
Name	N-(1,3-benzodioxol-5-ylmethyl)-N-(4-fluorophenyl)-N'-[2,2,2-trifluoro-1-methyl-1-(trifluoromethyl)ethyl]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/C19H15F7N2O3/c1-17(18(21,22)23,19(24,25)26)27-16(29)28(13-5-3-12(20)4-6-13)9-11-2-7-14-15(8-11)31-10-30-14/h2-8H,9-10H2,1H3,(H,27,29)
InChIKey	WZEZUSKJFUQOGS-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_3450
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: D11605; Labnumber: SOKOL-0292; SBI_ID: SBI-003452
Temperature	318 °C