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3-thiazolidineacetic acid, 5-(2H-1-benzopyran-3-ylmethylene)-alpha-(1-methylethyl)-4-oxo-2-thioxo-, (5E)-
SpectraBase Compound ID IzGosEiwUob
InChI InChI=1S/C18H17NO4S2/c1-10(2)15(17(21)22)19-16(20)14(25-18(19)24)8-11-7-12-5-3-4-6-13(12)23-9-11/h3-8,10,15H,9H2,1-2H3,(H,21,22)/b14-8+
InChIKey ZQNVGQATEPSXGF-RIYZIHGNSA-N
Mol Weight 375.46 g/mol
Molecular Formula C18H17NO4S2
Exact Mass 375.0599 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2n0rgK4Vypy
Name 3-thiazolidineacetic acid, 5-(2H-1-benzopyran-3-ylmethylene)-alpha-(1-methylethyl)-4-oxo-2-thioxo-, (5E)-
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/C18H17NO4S2/c1-10(2)15(17(21)22)19-16(20)14(25-18(19)24)8-11-7-12-5-3-4-6-13(12)23-9-11/h3-8,10,15H,9H2,1-2H3,(H,21,22)/b14-8+
InChIKey ZQNVGQATEPSXGF-RIYZIHGNSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_4037
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: F19887; Labnumber: EXGOR1-18477