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2-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-N-[3-(trifluoromethyl)benzyl]acetamide
SpectraBase Compound ID CelIW3QYZg1
InChI InChI=1S/C14H14F3N3OS/c1-20-6-5-18-13(20)22-9-12(21)19-8-10-3-2-4-11(7-10)14(15,16)17/h2-7H,8-9H2,1H3,(H,19,21)
InChIKey HSUVPSONSPWABY-UHFFFAOYSA-N
Mol Weight 329.34 g/mol
Molecular Formula C14H14F3N3OS
Exact Mass 329.080968 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6ixAQC3tBQ9
Name 2-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-N-[3-(trifluoromethyl)benzyl]acetamide
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/C14H14F3N3OS/c1-20-6-5-18-13(20)22-9-12(21)19-8-10-3-2-4-11(7-10)14(15,16)17/h2-7H,8-9H2,1H3,(H,19,21)
InChIKey HSUVPSONSPWABY-UHFFFAOYSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_2831
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/9313684; Labnumber: PNA-NA00825