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4-thiazolidinone, 3-[(1,1-dioxido-1,2-benzisothiazol-3-yl)amino]-5-[(3-nitrophenyl)methylene]-2-thioxo-, (5E)-
SpectraBase Compound ID 34GppfmpdM8
InChI InChI=1S/C17H10N4O5S3/c22-16-13(9-10-4-3-5-11(8-10)21(23)24)28-17(27)20(16)18-15-12-6-1-2-7-14(12)29(25,26)19-15/h1-9H,(H,18,19)/b13-9+
InChIKey SPCVHRWREZVNSO-UKTHLTGXSA-N
Mol Weight 446.47 g/mol
Molecular Formula C17H10N4O5S3
Exact Mass 445.981333 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ksssl89zqhr
Name 4-thiazolidinone, 3-[(1,1-dioxido-1,2-benzisothiazol-3-yl)amino]-5-[(3-nitrophenyl)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 445.981332955 u
Formula C17H10N4O5S3
InChI InChI=1S/C17H10N4O5S3/c22-16-13(9-10-4-3-5-11(8-10)21(23)24)28-17(27)20(16)18-15-12-6-1-2-7-14(12)29(25,26)19-15/h1-9H,(H,18,19)/b13-9+
InChIKey SPCVHRWREZVNSO-UKTHLTGXSA-N
Molecular Weight 446.470 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8569
Solvent DMSO-d6
Source Vendor ID: NMR/10210227; Lab Info: LP; Lab Number: LP-1900795