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

*Links on SpectraBase are not permalinks.

ethyl 4-({[3-cyano-6-(difluoromethyl)-4-(1,3-dimethyl-1H-pyrazol-4-yl)-2-pyridinyl]sulfanyl}methyl)-5-methyl-3-isoxazolecarboxylate

View entire compound with spectra: 1 NMR

ethyl 4-({[3-cyano-6-(difluoromethyl)-4-(1,3-dimethyl-1H-pyrazol-4-yl)-2-pyridinyl]sulfanyl}methyl)-5-methyl-3-isoxazolecarboxylate
SpectraBase Compound ID 1n4RIAk6f2s
InChI InChI=1S/C20H19F2N5O3S/c1-5-29-20(28)17-15(11(3)30-26-17)9-31-19-13(7-23)12(6-16(24-19)18(21)22)14-8-27(4)25-10(14)2/h6,8,18H,5,9H2,1-4H3
InChIKey OOOKCIZTCMDLOR-UHFFFAOYSA-N
Mol Weight 447.46 g/mol
Molecular Formula C20H19F2N5O3S
Exact Mass 447.117667 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 AcCef2FknzK
Name ethyl 4-({[3-cyano-6-(difluoromethyl)-4-(1,3-dimethyl-1H-pyrazol-4-yl)-2-pyridinyl]sulfanyl}methyl)-5-methyl-3-isoxazolecarboxylate
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/C20H19F2N5O3S/c1-5-29-20(28)17-15(11(3)30-26-17)9-31-19-13(7-23)12(6-16(24-19)18(21)22)14-8-27(4)25-10(14)2/h6,8,18H,5,9H2,1-4H3
InChIKey OOOKCIZTCMDLOR-UHFFFAOYSA-N
NMR Offset 15.3209
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_32561
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: 1867117; SBI_ID: SBI-032565
Temperature 297 °C