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methyl 2-[({[(3-methyl-1-benzothien-2-yl)carbonyl]oxy}acetyl)amino]-1,3-benzothiazole-6-carboxylate
SpectraBase Compound ID 9mpgmZClqqA
InChI InChI=1S/C21H16N2O5S2/c1-11-13-5-3-4-6-15(13)29-18(11)20(26)28-10-17(24)23-21-22-14-8-7-12(19(25)27-2)9-16(14)30-21/h3-9H,10H2,1-2H3,(H,22,23,24)
InChIKey LCBXKFCCJZNQRE-UHFFFAOYSA-N
Mol Weight 440.49 g/mol
Molecular Formula C21H16N2O5S2
Exact Mass 440.050064 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Hfg3pmNRBi7
Name methyl 2-[({[(3-methyl-1-benzothien-2-yl)carbonyl]oxy}acetyl)amino]-1,3-benzothiazole-6-carboxylate
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/C21H16N2O5S2/c1-11-13-5-3-4-6-15(13)29-18(11)20(26)28-10-17(24)23-21-22-14-8-7-12(19(25)27-2)9-16(14)30-21/h3-9H,10H2,1-2H3,(H,22,23,24)
InChIKey LCBXKFCCJZNQRE-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3282
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/8084753; UBI_ID: UBI-003283
Temperature 308 °C