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2-Acetylamino-2-(5-chloro-pyridin-2-ylamino)-3,3,3-trifluoro-propionic acid methyl ester

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2-Acetylamino-2-(5-chloro-pyridin-2-ylamino)-3,3,3-trifluoro-propionic acid methyl ester
SpectraBase Compound ID 4Mqx3mEmhXe
InChI InChI=1S/C11H11ClF3N3O3/c1-6(19)17-10(9(20)21-2,11(13,14)15)18-8-4-3-7(12)5-16-8/h3-5H,1-2H3,(H,16,18)(H,17,19)
InChIKey JYANCGHVWJETEK-UHFFFAOYSA-N
Mol Weight 325.68 g/mol
Molecular Formula C11H11ClF3N3O3
Exact Mass 325.044103 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7QBpunOppaY
Name methyl 2-(acetylamino)-2-[(5-chloro-2-pyridinyl)amino]-3,3,3-trifluoropropanoate
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/C11H11ClF3N3O3/c1-6(19)17-10(9(20)21-2,11(13,14)15)18-8-4-3-7(12)5-16-8/h3-5H,1-2H3,(H,16,18)(H,17,19)
InChIKey JYANCGHVWJETEK-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_382
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: C27036; Labnumber: SOK-0953; SBI_ID: SBI-000384
Temperature 308 °C