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6-cyclopropyl-2-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-(trifluoromethyl)nicotinonitrile
SpectraBase Compound ID 86falZtyAYE
InChI InChI=1S/C19H15F3N2O2S/c1-26-13-4-2-3-12(7-13)17(25)10-27-18-14(9-23)15(19(20,21)22)8-16(24-18)11-5-6-11/h2-4,7-8,11H,5-6,10H2,1H3
InChIKey FYASTLIRKXMTRB-UHFFFAOYSA-N
Mol Weight 392.4 g/mol
Molecular Formula C19H15F3N2O2S
Exact Mass 392.080633 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Avc1nCpLgvZ
Name 6-cyclopropyl-2-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-(trifluoromethyl)nicotinonitrile
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/C19H15F3N2O2S/c1-26-13-4-2-3-12(7-13)17(25)10-27-18-14(9-23)15(19(20,21)22)8-16(24-18)11-5-6-11/h2-4,7-8,11H,5-6,10H2,1H3
InChIKey FYASTLIRKXMTRB-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_9772
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: D60498; Labnumber: SHES3-0184; SBI_ID: SBI-009775
Temperature 308 °C