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acetamide, N-[4-[(5E)-5-[(2-methyl-2H-1-benzopyran-3-yl)methylene]-4-oxo-2-thioxothiazolidinyl]phenyl]-
SpectraBase Compound ID B8SqMcBL3fh
InChI InChI=1S/C22H18N2O3S2/c1-13-16(11-15-5-3-4-6-19(15)27-13)12-20-21(26)24(22(28)29-20)18-9-7-17(8-10-18)23-14(2)25/h3-13H,1-2H3,(H,23,25)/b20-12+
InChIKey IGOWHUJHGIVAAB-UDWIEESQSA-N
Mol Weight 422.52 g/mol
Molecular Formula C22H18N2O3S2
Exact Mass 422.075885 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2R7Xt2Bqjr5
Name acetamide, N-[4-[(5E)-5-[(2-methyl-2H-1-benzopyran-3-yl)methylene]-4-oxo-2-thioxothiazolidinyl]phenyl]-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C22H18N2O3S2/c1-13-16(11-15-5-3-4-6-19(15)27-13)12-20-21(26)24(22(28)29-20)18-9-7-17(8-10-18)23-14(2)25/h3-13H,1-2H3,(H,23,25)/b20-12+
InChIKey IGOWHUJHGIVAAB-UDWIEESQSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_7331
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: F30424; Labnumber: EXGOR1-18421