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4-((E)-[(3-Cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)imino]methyl)-2-methoxyphenyl acetate
SpectraBase Compound ID 9lcsrArAPlb
InChI InChI=1S/C19H18N2O3S/c1-12(22)24-16-8-7-13(9-17(16)23-2)11-21-19-15(10-20)14-5-3-4-6-18(14)25-19/h7-9,11H,3-6H2,1-2H3/b21-11+
InChIKey KYYPZVHXHQPXLD-SRZZPIQSSA-N
Mol Weight 354.42 g/mol
Molecular Formula C19H18N2O3S
Exact Mass 354.103814 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CXi7Fa3auim
Name benzo[b]thiophene-3-carbonitrile, 2-[[(E)-[4-(acetyloxy)-3-methoxyphenyl]methylidene]amino]-4,5,6,7-tetrahydro-
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/C19H18N2O3S/c1-12(22)24-16-8-7-13(9-17(16)23-2)11-21-19-15(10-20)14-5-3-4-6-18(14)25-19/h7-9,11H,3-6H2,1-2H3/b21-11+
InChIKey KYYPZVHXHQPXLD-SRZZPIQSSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_7132
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: SADD/5680838; IOH_ID: IOH-014136