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benzenecarbohydrazonothioic acid, 4-nitro-N-phenyl-, 8-quinolinyl ester
SpectraBase Compound ID 9kPCElGodmn
InChI InChI=1S/C22H16N4O2S/c27-26(28)19-13-11-17(12-14-19)22(25-24-18-8-2-1-3-9-18)29-20-10-4-6-16-7-5-15-23-21(16)20/h1-15,24H/b25-22+
InChIKey ZSMVCPDJQWLLMS-YYDJUVGSSA-N
Mol Weight 400.46 g/mol
Molecular Formula C22H16N4O2S
Exact Mass 400.099397 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2zOWu2JdZ28
Name benzenecarbohydrazonothioic acid, 4-nitro-N-phenyl-, 8-quinolinyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.099396943 u
Formula C22H16N4O2S
InChI InChI=1S/C22H16N4O2S/c27-26(28)19-13-11-17(12-14-19)22(25-24-18-8-2-1-3-9-18)29-20-10-4-6-16-7-5-15-23-21(16)20/h1-15,24H/b25-22+
InChIKey ZSMVCPDJQWLLMS-YYDJUVGSSA-N
Molecular Weight 400.456 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_469
Solvent DMSO-d6
Source Vendor ID: ZI/6047967; Lab Info: LP; Lab Number: lp-03/56
Temperature 29.85 °C