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2-{[(E)-(5-bromo-2-isopropoxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
SpectraBase Compound ID 60ih7OBPIrz
InChI InChI=1S/C19H19BrN2OS/c1-12(2)23-17-8-7-14(20)9-13(17)11-22-19-16(10-21)15-5-3-4-6-18(15)24-19/h7-9,11-12H,3-6H2,1-2H3/b22-11+
InChIKey NDNKNSMDPDFLCV-SSDVNMTOSA-N
Mol Weight 403.34 g/mol
Molecular Formula C19H19BrN2OS
Exact Mass 402.040147 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5lJEYv6GZOv
Name 2-{[(E)-(5-bromo-2-isopropoxyphenyl)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/C19H19BrN2OS/c1-12(2)23-17-8-7-14(20)9-13(17)11-22-19-16(10-21)15-5-3-4-6-18(15)24-19/h7-9,11-12H,3-6H2,1-2H3/b22-11+
InChIKey NDNKNSMDPDFLCV-SSDVNMTOSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_3684
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/7093544; Labnumber: SAD-e900260; IOH_ID: IOH-003685
Synonyms 2-{[(5-bromo-2-isopropoxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Temperature 303 °C