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(5E)-5-(5-bromo-2-methoxybenzylidene)-2-hexahydro-1H-azepin-1-yl-1,3-thiazol-4(5H)-one

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(5E)-5-(5-bromo-2-methoxybenzylidene)-2-hexahydro-1H-azepin-1-yl-1,3-thiazol-4(5H)-one
SpectraBase Compound ID C8SV09SECFV
InChI InChI=1S/C17H19BrN2O2S/c1-22-14-7-6-13(18)10-12(14)11-15-16(21)19-17(23-15)20-8-4-2-3-5-9-20/h6-7,10-11H,2-5,8-9H2,1H3/b15-11+
InChIKey YAUOTEBJFFZFOO-RVDMUPIBSA-N
Mol Weight 395.32 g/mol
Molecular Formula C17H19BrN2O2S
Exact Mass 394.035062 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LoY5bBFu6qK
Name (5E)-5-(5-bromo-2-methoxybenzylidene)-2-hexahydro-1H-azepin-1-yl-1,3-thiazol-4(5H)-one
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/C17H19BrN2O2S/c1-22-14-7-6-13(18)10-12(14)11-15-16(21)19-17(23-15)20-8-4-2-3-5-9-20/h6-7,10-11H,2-5,8-9H2,1H3/b15-11+
InChIKey YAUOTEBJFFZFOO-RVDMUPIBSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12174
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: 1002139; UBI_ID: UBI-012177
Synonyms 5-(5-bromo-2-methoxybenzylidene)-2-hexahydro-1H-azepin-1-yl-1,3-thiazol-4(5H)-one
Temperature 313 °C