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2,4-thiazolidinedione, 5-[[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylene]-3-methyl-, (5E)-
SpectraBase Compound ID 4Tt1PMPmgIT
InChI InChI=1S/C17H15N3O4S/c1-10-8-12(9-15-16(21)18(3)17(22)25-15)11(2)19(10)13-4-6-14(7-5-13)20(23)24/h4-9H,1-3H3/b15-9+
InChIKey ZXNNYENGLXFRLJ-OQLLNIDSSA-N
Mol Weight 357.38 g/mol
Molecular Formula C17H15N3O4S
Exact Mass 357.078327 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KFlAIRnGJNI
Name 2,4-thiazolidinedione, 5-[[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylene]-3-methyl-, (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 357.078327145 u
Formula C17H15N3O4S
InChI InChI=1S/C17H15N3O4S/c1-10-8-12(9-15-16(21)18(3)17(22)25-15)11(2)19(10)13-4-6-14(7-5-13)20(23)24/h4-9H,1-3H3/b15-9+
InChIKey ZXNNYENGLXFRLJ-OQLLNIDSSA-N
Molecular Weight 357.384 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_352
Solvent DMSO-d6
Source Vendor ID: ZI/7113210; Lab Info: LD; Lab Number: LD-1390667
Temperature 29.85 °C