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2-thiazoleacetonitrile, 4-(6,8-dichloro-2-oxo-2H-1-benzopyran-3-yl)-alpha-[(3-methyl-2-thienyl)methylene]-
SpectraBase Compound ID LGshfvGtBqC
InChI InChI=1S/C20H10Cl2N2O2S2/c1-10-2-3-27-17(10)6-12(8-23)19-24-16(9-28-19)14-5-11-4-13(21)7-15(22)18(11)26-20(14)25/h2-7,9H,1H3/b12-6+
InChIKey CESUPOIRKOBBDA-WUXMJOGZSA-N
Mol Weight 445.34 g/mol
Molecular Formula C20H10Cl2N2O2S2
Exact Mass 443.956075 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DIY151zOgz3
Name 2-thiazoleacetonitrile, 4-(6,8-dichloro-2-oxo-2H-1-benzopyran-3-yl)-alpha-[(3-methyl-2-thienyl)methylene]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 443.956075316 u
Formula C20H10Cl2N2O2S2
InChI InChI=1S/C20H10Cl2N2O2S2/c1-10-2-3-27-17(10)6-12(8-23)19-24-16(9-28-19)14-5-11-4-13(21)7-15(22)18(11)26-20(14)25/h2-7,9H,1H3/b12-6+
InChIKey CESUPOIRKOBBDA-WUXMJOGZSA-N
Molecular Weight 445.338 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9213
Solvent DMSO-d6
Source Vendor ID: NMR/9253052; Lab Info: DVD; Lab Number: DVD-0000030