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methyl 2-[({2-[(4-bromo-2-chlorophenoxy)acetyl]hydrazino}carbothioyl)amino]-5-methyl-4-phenyl-3-thiophenecarboxylate
SpectraBase Compound ID Lk0REJ33QQO
InChI InChI=1S/C22H19BrClN3O4S2/c1-12-18(13-6-4-3-5-7-13)19(21(29)30-2)20(33-12)25-22(32)27-26-17(28)11-31-16-9-8-14(23)10-15(16)24/h3-10H,11H2,1-2H3,(H,26,28)(H2,25,27,32)
InChIKey YFFFXYRQPBRYHS-UHFFFAOYSA-N
Mol Weight 568.89 g/mol
Molecular Formula C22H19BrClN3O4S2
Exact Mass 566.968889 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FTUgcYZk2G5
Name methyl 2-[({2-[(4-bromo-2-chlorophenoxy)acetyl]hydrazino}carbothioyl)amino]-5-methyl-4-phenyl-3-thiophenecarboxylate
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/C22H19BrClN3O4S2/c1-12-18(13-6-4-3-5-7-13)19(21(29)30-2)20(33-12)25-22(32)27-26-17(28)11-31-16-9-8-14(23)10-15(16)24/h3-10H,11H2,1-2H3,(H,26,28)(H2,25,27,32)
InChIKey YFFFXYRQPBRYHS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7581
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/1270155; Labnumber: COL5488; UZI_ID: UZI-007583
Temperature 318 °C