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6-Amino-5-cyano-2-methyl-4-(trifluoromethyl)-3-pyridinecarboxylic acid methyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

6-Amino-5-cyano-2-methyl-4-(trifluoromethyl)-3-pyridinecarboxylic acid methyl ester
SpectraBase Compound ID U24qLyqhpe
InChI InChI=1S/C10H8F3N3O2/c1-4-6(9(17)18-2)7(10(11,12)13)5(3-14)8(15)16-4/h1-2H3,(H2,15,16)
InChIKey DVOZWXGPFRCWMZ-UHFFFAOYSA-N
Mol Weight 259.19 g/mol
Molecular Formula C10H8F3N3O2
Exact Mass 259.056861 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BNf06Ql1jZR
Name methyl 6-amino-5-cyano-2-methyl-4-(trifluoromethyl)nicotinate
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/C10H8F3N3O2/c1-4-6(9(17)18-2)7(10(11,12)13)5(3-14)8(15)16-4/h1-2H3,(H2,15,16)
InChIKey DVOZWXGPFRCWMZ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_1322
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: C95985; Labnumber: AKSIN-0084; SBI_ID: SBI-001324
Temperature 315 °C