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methyl 2-({[2-(5-bromo-2-furoyl)hydrazino]carbothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID L9KxvlIjXty
InChI InChI=1S/C16H16BrN3O4S2/c1-23-15(22)12-8-4-2-3-5-10(8)26-14(12)18-16(25)20-19-13(21)9-6-7-11(17)24-9/h6-7H,2-5H2,1H3,(H,19,21)(H2,18,20,25)
InChIKey MXWWHTCHYURRLP-UHFFFAOYSA-N
Mol Weight 458.35 g/mol
Molecular Formula C16H16BrN3O4S2
Exact Mass 456.976561 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1rfDhgtoMrx
Name methyl 2-({[2-(5-bromo-2-furoyl)hydrazino]carbothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C16H16BrN3O4S2/c1-23-15(22)12-8-4-2-3-5-10(8)26-14(12)18-16(25)20-19-13(21)9-6-7-11(17)24-9/h6-7H,2-5H2,1H3,(H,19,21)(H2,18,20,25)
InChIKey MXWWHTCHYURRLP-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7722
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: UZI/1270164; Labnumber: COL5939; UZI_ID: UZI-007724
Temperature 318 °C