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4-{(E)-[(aminocarbothioyl)hydrazono]methyl}-2-bromo-6-ethoxyphenyl benzoate
SpectraBase Compound ID Gip09iWDoKx
InChI InChI=1S/C17H16BrN3O3S/c1-2-23-14-9-11(10-20-21-17(19)25)8-13(18)15(14)24-16(22)12-6-4-3-5-7-12/h3-10H,2H2,1H3,(H3,19,21,25)/b20-10+
InChIKey MLSFQQOORJYYIM-KEBDBYFISA-N
Mol Weight 422.3 g/mol
Molecular Formula C17H16BrN3O3S
Exact Mass 421.009576 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HIKc959DVCf
Name 4-{(E)-[(aminocarbothioyl)hydrazono]methyl}-2-bromo-6-ethoxyphenyl benzoate
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/C17H16BrN3O3S/c1-2-23-14-9-11(10-20-21-17(19)25)8-13(18)15(14)24-16(22)12-6-4-3-5-7-12/h3-10H,2H2,1H3,(H3,19,21,25)/b20-10+
InChIKey MLSFQQOORJYYIM-KEBDBYFISA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10166
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: 9151999; UBI_ID: UBI-010169
Synonyms 4-{[(aminocarbothioyl)hydrazono]methyl}-2-bromo-6-ethoxyphenyl benzoate
Temperature 315 °C