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(5E)-5-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylene}-2-thioxo-1,3-thiazolidin-4-one
SpectraBase Compound ID 46TWi6p0LhJ
InChI InChI=1S/C16H13N3O3S2/c1-9-7-11(8-14-15(20)17-16(23)24-14)10(2)18(9)12-3-5-13(6-4-12)19(21)22/h3-8H,1-2H3,(H,17,20,23)/b14-8+
InChIKey PVEAHQYFKKGFKQ-RIYZIHGNSA-N
Mol Weight 359.42 g/mol
Molecular Formula C16H13N3O3S2
Exact Mass 359.039834 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G10JDEzop1S
Name 4-thiazolidinone, 5-[[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylene]-2-thioxo-, (5E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 359.039833636 u
Formula C16H13N3O3S2
InChI InChI=1S/C16H13N3O3S2/c1-9-7-11(8-14-15(20)17-16(23)24-14)10(2)18(9)12-3-5-13(6-4-12)19(21)22/h3-8H,1-2H3,(H,17,20,23)/b14-8+
InChIKey PVEAHQYFKKGFKQ-RIYZIHGNSA-N
Molecular Weight 359.418 g/mol
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_155
Solvent DMSO-d6
Source Vendor ID: ZI/7111957; Lab Info: LD; Lab Number: LD-1390666
Temperature 23.85 °C