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ethyl 4-({[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridinyl]sulfanyl}methyl)-5-methyl-3-isoxazolecarboxylate
SpectraBase Compound ID EF2CPuBBn3E
InChI InChI=1S/C16H14F3N3O3S/c1-4-24-15(23)13-11(9(3)25-22-13)7-26-14-10(6-20)8(2)5-12(21-14)16(17,18)19/h5H,4,7H2,1-3H3
InChIKey UGXOQMSQQIIZRB-UHFFFAOYSA-N
Mol Weight 385.36 g/mol
Molecular Formula C16H14F3N3O3S
Exact Mass 385.070797 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6sDXTR0NPAX
Name ethyl 4-({[3-cyano-4-methyl-6-(trifluoromethyl)-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/C16H14F3N3O3S/c1-4-24-15(23)13-11(9(3)25-22-13)7-26-14-10(6-20)8(2)5-12(21-14)16(17,18)19/h5H,4,7H2,1-3H3
InChIKey UGXOQMSQQIIZRB-UHFFFAOYSA-N
NMR Offset 17.9122
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_32659
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: 1897113; SBI_ID: SBI-032663
Temperature 303 °C