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ethyl 5-(2,5-dichloroanilino)-3-methyl-4-isothiazolecarboxylate
SpectraBase Compound ID CK3WYmvXZBR
InChI InChI=1S/C13H12Cl2N2O2S/c1-3-19-13(18)11-7(2)17-20-12(11)16-10-6-8(14)4-5-9(10)15/h4-6,16H,3H2,1-2H3
InChIKey LYVSDCYFURROGR-UHFFFAOYSA-N
Mol Weight 331.22 g/mol
Molecular Formula C13H12Cl2N2O2S
Exact Mass 329.999654 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID L787QQE40E5
Name ethyl 5-(2,5-dichloroanilino)-3-methyl-4-isothiazolecarboxylate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 329.999654206 u
Formula C13H12Cl2N2O2S
InChI InChI=1S/C13H12Cl2N2O2S/c1-3-19-13(18)11-7(2)17-20-12(11)16-10-6-8(14)4-5-9(10)15/h4-6,16H,3H2,1-2H3
InChIKey LYVSDCYFURROGR-UHFFFAOYSA-N
Molecular Weight 331.217 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_3490
Solvent DMSO-d6
Source Vendor ID: NMR/12289605