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{4-bromo-2-[(Z)-(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}acetonitrile
SpectraBase Compound ID 71uTb2QX4Qt
InChI InChI=1S/C12H8BrN3O2S/c13-8-1-2-9(18-4-3-14)7(5-8)6-10-11(17)16-12(15)19-10/h1-2,5-6H,4H2,(H2,15,16,17)/b10-6-
InChIKey KTOWRBCSTQSWLC-POHAHGRESA-N
Mol Weight 338.18 g/mol
Molecular Formula C12H8BrN3O2S
Exact Mass 336.952061 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 88bfhFBNFxv
Name {4-bromo-2-[(Z)-(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}acetonitrile
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/C12H8BrN3O2S/c13-8-1-2-9(18-4-3-14)7(5-8)6-10-11(17)16-12(15)19-10/h1-2,5-6H,4H2,(H2,15,16,17)/b10-6-
InChIKey KTOWRBCSTQSWLC-POHAHGRESA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_5353
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/9322861; Labnumber: BMWA-196393; UZI_ID: UZI-005355
Synonyms {4-bromo-2-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}acetonitrile
Temperature 318 °C