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acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-[[3-cyano-6-phenyl-4-(trifluoromethyl)-2-pyridinyl]thio]-
SpectraBase Compound ID 8UnBD3e09oS
InChI InChI=1S/C23H12F9N3OS/c24-21(25,26)13-6-14(22(27,28)29)8-15(7-13)34-19(36)11-37-20-16(10-33)17(23(30,31)32)9-18(35-20)12-4-2-1-3-5-12/h1-9H,11H2,(H,34,36)
InChIKey YQHBWQYLFYUSHB-UHFFFAOYSA-N
Mol Weight 549.41 g/mol
Molecular Formula C23H12F9N3OS
Exact Mass 549.055737 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Dv0FqZea8ZB
Name acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-[[3-cyano-6-phenyl-4-(trifluoromethyl)-2-pyridinyl]thio]-
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/C23H12F9N3OS/c24-21(25,26)13-6-14(22(27,28)29)8-15(7-13)34-19(36)11-37-20-16(10-33)17(23(30,31)32)9-18(35-20)12-4-2-1-3-5-12/h1-9H,11H2,(H,34,36)
InChIKey YQHBWQYLFYUSHB-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_CB_8313_6260
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: NMR/10261620; Labnumber: NKS-ACA0294
Temperature 297 °C