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2-{[(E)-(1-methyl-2-phenyl-1H-indol-3-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
SpectraBase Compound ID LbdEiUmvQ4z
InChI InChI=1S/C25H21N3S/c1-28-22-13-7-5-11-18(22)21(24(28)17-9-3-2-4-10-17)16-27-25-20(15-26)19-12-6-8-14-23(19)29-25/h2-5,7,9-11,13,16H,6,8,12,14H2,1H3/b27-16+
InChIKey RDFUYBRIWNCGBU-JVWAILMASA-N
Mol Weight 395.52 g/mol
Molecular Formula C25H21N3S
Exact Mass 395.145619 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A98oZnQtb11
Name 2-{[(E)-(1-methyl-2-phenyl-1H-indol-3-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 395.145618862 u
Formula C25H21N3S
InChI InChI=1S/C25H21N3S/c1-28-22-13-7-5-11-18(22)21(24(28)17-9-3-2-4-10-17)16-27-25-20(15-26)19-12-6-8-14-23(19)29-25/h2-5,7,9-11,13,16H,6,8,12,14H2,1H3/b27-16+
InChIKey RDFUYBRIWNCGBU-JVWAILMASA-N
Molecular Weight 395.524 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_966
Solvent DMSO-d6
Source Vendor ID: NMR/12269018