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methyl 2-{[[(2E)-2-(3,4-dichlorobenzylidene)hydrazino](oxo)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

View entire compound with spectra: 1 NMR

methyl 2-{[[(2E)-2-(3,4-dichlorobenzylidene)hydrazino](oxo)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID Kb6We7J2qAf
InChI InChI=1S/C19H17Cl2N3O4S/c1-28-19(27)15-11-4-2-3-5-14(11)29-18(15)23-16(25)17(26)24-22-9-10-6-7-12(20)13(21)8-10/h6-9H,2-5H2,1H3,(H,23,25)(H,24,26)/b22-9+
InChIKey FIMBICGEAWFWNI-LSFURLLWSA-N
Mol Weight 454.33 g/mol
Molecular Formula C19H17Cl2N3O4S
Exact Mass 453.031683 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6zTwIein2tH
Name methyl 2-{[[(2E)-2-(3,4-dichlorobenzylidene)hydrazino](oxo)acetyl]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/C19H17Cl2N3O4S/c1-28-19(27)15-11-4-2-3-5-14(11)29-18(15)23-16(25)17(26)24-22-9-10-6-7-12(20)13(21)8-10/h6-9H,2-5H2,1H3,(H,23,25)(H,24,26)/b22-9+
InChIKey FIMBICGEAWFWNI-LSFURLLWSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21193
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: D51883; Labnumber: NIG-P0173; SBI_ID: SBI-021197
Synonyms methyl 2-{[[2-(3,4-dichlorobenzylidene)hydrazino](oxo)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Temperature 318 °C