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N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-5-[(2,4-dichlorophenoxy)methyl]-2-furamide
SpectraBase Compound ID 3STYrRYpHKc
InChI InChI=1S/C22H18Cl2N2O3S/c23-13-6-8-18(17(24)10-13)28-12-14-7-9-19(29-14)21(27)26-22-16(11-25)15-4-2-1-3-5-20(15)30-22/h6-10H,1-5,12H2,(H,26,27)
InChIKey KQBWBFFYXFFLHX-UHFFFAOYSA-N
Mol Weight 461.36 g/mol
Molecular Formula C22H18Cl2N2O3S
Exact Mass 460.041519 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J17Y2eGEkzB
Name N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-5-[(2,4-dichlorophenoxy)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/C22H18Cl2N2O3S/c23-13-6-8-18(17(24)10-13)28-12-14-7-9-19(29-14)21(27)26-22-16(11-25)15-4-2-1-3-5-20(15)30-22/h6-10H,1-5,12H2,(H,26,27)
InChIKey KQBWBFFYXFFLHX-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5065
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/8144310; UBI_ID: UBI-005067
Temperature 308 °C