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3-pyridinecarbonitrile, 6-ethyl-2-mercapto-5-methyl-4-(trifluoromethyl)-

View entire compound with spectra: 1 NMR

3-pyridinecarbonitrile, 6-ethyl-2-mercapto-5-methyl-4-(trifluoromethyl)-
SpectraBase Compound ID 7Jb3KEIzrDO
InChI InChI=1S/C10H9F3N2S/c1-3-7-5(2)8(10(11,12)13)6(4-14)9(16)15-7/h3H2,1-2H3,(H,15,16)
InChIKey IKYGREJSMLDBTB-UHFFFAOYSA-N
Mol Weight 246.25 g/mol
Molecular Formula C10H9F3N2S
Exact Mass 246.043854 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HG9Z3fReR1S
Name 3-pyridinecarbonitrile, 6-ethyl-2-mercapto-5-methyl-4-(trifluoromethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 246.043853961 u
Formula C10H9F3N2S
InChI InChI=1S/C10H9F3N2S/c1-3-7-5(2)8(10(11,12)13)6(4-14)9(16)15-7/h3H2,1-2H3,(H,15,16)
InChIKey IKYGREJSMLDBTB-UHFFFAOYSA-N
Molecular Weight 246.251 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2189
Solvent DMSO-d6
Source Vendor ID: NMR/13268410