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1H-benzimidazole-2-acetonitrile, alpha-[(3-bromo-5-ethoxy-4-methoxyphenyl)methylene]-
SpectraBase Compound ID 75tdAC32Imi
InChI InChI=1S/C19H16BrN3O2/c1-3-25-17-10-12(9-14(20)18(17)24-2)8-13(11-21)19-22-15-6-4-5-7-16(15)23-19/h4-10H,3H2,1-2H3,(H,22,23)/b13-8+
InChIKey WJTJEGYWMZMNDW-MDWZMJQESA-N
Mol Weight 398.26 g/mol
Molecular Formula C19H16BrN3O2
Exact Mass 397.04259 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KsQpbf4X1wC
Name 1H-benzimidazole-2-acetonitrile, alpha-[(3-bromo-5-ethoxy-4-methoxyphenyl)methylene]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 397.042589765 u
Formula C19H16BrN3O2
InChI InChI=1S/C19H16BrN3O2/c1-3-25-17-10-12(9-14(20)18(17)24-2)8-13(11-21)19-22-15-6-4-5-7-16(15)23-19/h4-10H,3H2,1-2H3,(H,22,23)/b13-8+
InChIKey WJTJEGYWMZMNDW-MDWZMJQESA-N
Molecular Weight 398.260 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_2205
Solvent DMSO-d6
Source Vendor ID: ZI/7075477; Lab Info: SAD; Lab Number: SAD-e500234
Temperature 29.85 °C