For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
N-(1,3-benzodioxol-5-ylmethyl)-N-benzyl-N'-[2,2,2-trifluoro-1-methyl-1-(trifluoromethyl)ethyl]urea
SpectraBase Compound ID CrzDSABfp5z
InChI InChI=1S/C20H18F6N2O3/c1-18(19(21,22)23,20(24,25)26)27-17(29)28(10-13-5-3-2-4-6-13)11-14-7-8-15-16(9-14)31-12-30-15/h2-9H,10-12H2,1H3,(H,27,29)
InChIKey RQRJKOKZSFDJAQ-UHFFFAOYSA-N
Mol Weight 448.37 g/mol
Molecular Formula C20H18F6N2O3
Exact Mass 448.122161 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GfBdP2J2y4A
Name N-(1,3-benzodioxol-5-ylmethyl)-N-benzyl-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/C20H18F6N2O3/c1-18(19(21,22)23,20(24,25)26)27-17(29)28(10-13-5-3-2-4-6-13)11-14-7-8-15-16(9-14)31-12-30-15/h2-9H,10-12H2,1H3,(H,27,29)
InChIKey RQRJKOKZSFDJAQ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3451
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: D11606; Labnumber: SOKOL-0300; SBI_ID: SBI-003453
Temperature 318 °C