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ethyl 2-({(2E)-2-cyano-3-[5-(3-nitrophenyl)-2-furyl]-2-propenoyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 5DERqfAiOfJ
InChI InChI=1S/C26H23N3O6S/c1-3-34-26(31)23-20-9-7-15(2)11-22(20)36-25(23)28-24(30)17(14-27)13-19-8-10-21(35-19)16-5-4-6-18(12-16)29(32)33/h4-6,8,10,12-13,15H,3,7,9,11H2,1-2H3,(H,28,30)/b17-13+
InChIKey RSIVSABVZOHYEN-GHRIWEEISA-N
Mol Weight 505.55 g/mol
Molecular Formula C26H23N3O6S
Exact Mass 505.130757 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IImTXBObI9T
Name ethyl 2-({(2E)-2-cyano-3-[5-(3-nitrophenyl)-2-furyl]-2-propenoyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-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/C26H23N3O6S/c1-3-34-26(31)23-20-9-7-15(2)11-22(20)36-25(23)28-24(30)17(14-27)13-19-8-10-21(35-19)16-5-4-6-18(12-16)29(32)33/h4-6,8,10,12-13,15H,3,7,9,11H2,1-2H3,(H,28,30)/b17-13+
InChIKey RSIVSABVZOHYEN-GHRIWEEISA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14692
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: C25983; Labnumber: MAT3-0015; SBI_ID: SBI-014695
Synonyms ethyl 2-({2-cyano-3-[5-(3-nitrophenyl)-2-furyl]-2-propenoyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Temperature 318 °C