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diisopropyl 5-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}-3-methyl-2,4-thiophenedicarboxylate
SpectraBase Compound ID ClSqnAEush6
InChI InChI=1S/C22H22ClNO5S2/c1-10(2)28-21(26)15-12(5)17(22(27)29-11(3)4)31-20(15)24-19(25)18-16(23)13-8-6-7-9-14(13)30-18/h6-11H,1-5H3,(H,24,25)
InChIKey YGJAEHIWRJZDBZ-UHFFFAOYSA-N
Mol Weight 479.99 g/mol
Molecular Formula C22H22ClNO5S2
Exact Mass 479.062793 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IE4tSyI3aW9
Name diisopropyl 5-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}-3-methyl-2,4-thiophenedicarboxylate
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/C22H22ClNO5S2/c1-10(2)28-21(26)15-12(5)17(22(27)29-11(3)4)31-20(15)24-19(25)18-16(23)13-8-6-7-9-14(13)30-18/h6-11H,1-5H3,(H,24,25)
InChIKey YGJAEHIWRJZDBZ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_14189
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: UZI/8195391; Labnumber: NSB0058289; UZI_ID: UZI-014193
Temperature 318 °C