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N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-5-[(3,4-dimethylphenoxy)methyl]-2-furamide
SpectraBase Compound ID LYEWuFhWvlD
InChI InChI=1S/C27H30N2O3S/c1-16-6-8-19(12-17(16)2)31-15-20-9-11-23(32-20)25(30)29-26-22(14-28)21-10-7-18(27(3,4)5)13-24(21)33-26/h6,8-9,11-12,18H,7,10,13,15H2,1-5H3,(H,29,30)
InChIKey HVRMDYXMINIAIJ-UHFFFAOYSA-N
Mol Weight 462.61 g/mol
Molecular Formula C27H30N2O3S
Exact Mass 462.197714 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LaGDnz7rZ9w
Name N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-5-[(3,4-dimethylphenoxy)methyl]-2-furamide
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/C27H30N2O3S/c1-16-6-8-19(12-17(16)2)31-15-20-9-11-23(32-20)25(30)29-26-22(14-28)21-10-7-18(27(3,4)5)13-24(21)33-26/h6,8-9,11-12,18H,7,10,13,15H2,1-5H3,(H,29,30)
InChIKey HVRMDYXMINIAIJ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10970
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/9079052; UBI_ID: UBI-010973
Temperature 308 °C