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2-benzothiazoleacetonitrile, alpha-[(4-hydroxy-3-nitrophenyl)methylene]-
SpectraBase Compound ID 9sfpFnMUvtu
InChI InChI=1S/C16H9N3O3S/c17-9-11(16-18-12-3-1-2-4-15(12)23-16)7-10-5-6-14(20)13(8-10)19(21)22/h1-8,20H/b11-7+
InChIKey LTPIGUOTELOGDK-YRNVUSSQSA-N
Mol Weight 323.33 g/mol
Molecular Formula C16H9N3O3S
Exact Mass 323.036462 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Cp0U56glutp
Name 2-benzothiazoleacetonitrile, alpha-[(4-hydroxy-3-nitrophenyl)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 323.036462333 u
Formula C16H9N3O3S
InChI InChI=1S/C16H9N3O3S/c17-9-11(16-18-12-3-1-2-4-15(12)23-16)7-10-5-6-14(20)13(8-10)19(21)22/h1-8,20H/b11-7+
InChIKey LTPIGUOTELOGDK-YRNVUSSQSA-N
Molecular Weight 323.326 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9165
Solvent DMSO-d6
Source Vendor ID: NMR/9234002; Lab Info: LP; Lab Number: LP-0340010