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

*Links on SpectraBase are not permalinks.
5-methyl-N-[2-(1H-pyrazol-1-yl)ethyl]-4-{[3-(trifluoromethyl)phenoxy]methyl}-3-isoxazolecarboxamide
SpectraBase Compound ID AU96Kgxl11i
InChI InChI=1S/C18H17F3N4O3/c1-12-15(11-27-14-5-2-4-13(10-14)18(19,20)21)16(24-28-12)17(26)22-7-9-25-8-3-6-23-25/h2-6,8,10H,7,9,11H2,1H3,(H,22,26)
InChIKey XGQURYCTBWQIHI-UHFFFAOYSA-N
Mol Weight 394.35 g/mol
Molecular Formula C18H17F3N4O3
Exact Mass 394.125275 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 KRbThcsxmFH
Name 5-methyl-N-[2-(1H-pyrazol-1-yl)ethyl]-4-{[3-(trifluoromethyl)phenoxy]methyl}-3-isoxazolecarboxamide
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/C18H17F3N4O3/c1-12-15(11-27-14-5-2-4-13(10-14)18(19,20)21)16(24-28-12)17(26)22-7-9-25-8-3-6-23-25/h2-6,8,10H,7,9,11H2,1H3,(H,22,26)
InChIKey XGQURYCTBWQIHI-UHFFFAOYSA-N
NMR Offset 17.9129
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_32094
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: 1844573; SBI_ID: SBI-032098
Temperature 303 °C