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4-amino-6-methyl-2-(trifluoromethyl)-3-quinolinecarbonitrile
SpectraBase Compound ID 8Sds2AcjfRz
InChI InChI=1S/C12H8F3N3/c1-6-2-3-9-7(4-6)10(17)8(5-16)11(18-9)12(13,14)15/h2-4H,1H3,(H2,17,18)
InChIKey WDVGRZJJCSPCDM-UHFFFAOYSA-N
Mol Weight 251.21 g/mol
Molecular Formula C12H8F3N3
Exact Mass 251.067032 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 72NNii02jt8
Name 3-quinolinecarbonitrile, 4-amino-6-methyl-2-(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 251.067031759 u
Formula C12H8F3N3
InChI InChI=1S/C12H8F3N3/c1-6-2-3-9-7(4-6)10(17)8(5-16)11(18-9)12(13,14)15/h2-4H,1H3,(H2,17,18)
InChIKey WDVGRZJJCSPCDM-UHFFFAOYSA-N
Molecular Weight 251.212 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15542
Solvent DMSO-d6
Source Vendor ID: ZI/10039735; Lab Info: SIZ; Lab Number: SIZ-0417042