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methyl 4-cyano-5-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)-3-methyl-2-thiophenecarboxylate

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methyl 4-cyano-5-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)-3-methyl-2-thiophenecarboxylate
SpectraBase Compound ID 60hdEkYqKsX
InChI InChI=1S/C16H14N2O4S/c1-8-11(7-17)15(23-12(8)16(21)22-2)18-13(19)9-5-3-4-6-10(9)14(18)20/h3-4,9-10H,5-6H2,1-2H3
InChIKey KUKOXFGXHCJLLG-UHFFFAOYSA-N
Mol Weight 330.36 g/mol
Molecular Formula C16H14N2O4S
Exact Mass 330.067428 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8RFUa3nwPif
Name methyl 4-cyano-5-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)-3-methyl-2-thiophenecarboxylate
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/C16H14N2O4S/c1-8-11(7-17)15(23-12(8)16(21)22-2)18-13(19)9-5-3-4-6-10(9)14(18)20/h3-4,9-10H,5-6H2,1-2H3
InChIKey KUKOXFGXHCJLLG-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_16169
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/1008683; Labnumber: NSB-0100922; UZI_ID: UZI-016173
Temperature 318 °C