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2-{[(E)-(7-methoxy-1,3-benzodioxol-5-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
SpectraBase Compound ID GyWKfy41P4Y
InChI InChI=1S/C18H16N2O3S/c1-21-14-6-11(7-15-17(14)23-10-22-15)9-20-18-13(8-19)12-4-2-3-5-16(12)24-18/h6-7,9H,2-5,10H2,1H3/b20-9+
InChIKey RWBOKVNAAGIFND-AWQFTUOYSA-N
Mol Weight 340.4 g/mol
Molecular Formula C18H16N2O3S
Exact Mass 340.088164 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GNMiDSehCj0
Name 2-{[(E)-(7-methoxy-1,3-benzodioxol-5-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
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/C18H16N2O3S/c1-21-14-6-11(7-15-17(14)23-10-22-15)9-20-18-13(8-19)12-4-2-3-5-16(12)24-18/h6-7,9H,2-5,10H2,1H3/b20-9+
InChIKey RWBOKVNAAGIFND-AWQFTUOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_3486
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: ZI/7061819; Labnumber: SAD-e600043; IOH_ID: IOH-003487
Synonyms 2-{[(7-methoxy-1,3-benzodioxol-5-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Temperature 297 °C