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(9E)-9-[4-(difluoromethoxy)benzylidene]-5-[4-(difluoromethoxy)phenyl]-3-phenyl-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
SpectraBase Compound ID 8LAcuW9jMA2
InChI InChI=1S/C31H24F4N2O2S/c32-29(33)38-23-13-9-19(10-14-23)17-22-7-4-8-25-27(22)36-31-37(26(18-40-31)20-5-2-1-3-6-20)28(25)21-11-15-24(16-12-21)39-30(34)35/h1-3,5-6,9-18,28-30H,4,7-8H2/b22-17+
InChIKey SMMDLKRXPIRZEF-OQKWZONESA-N
Mol Weight 564.6 g/mol
Molecular Formula C31H24F4N2O2S
Exact Mass 564.149462 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ACyGwgNfejy
Name (9E)-9-[4-(difluoromethoxy)benzylidene]-5-[4-(difluoromethoxy)phenyl]-3-phenyl-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
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/C31H24F4N2O2S/c32-29(33)38-23-13-9-19(10-14-23)17-22-7-4-8-25-27(22)36-31-37(26(18-40-31)20-5-2-1-3-6-20)28(25)21-11-15-24(16-12-21)39-30(34)35/h1-3,5-6,9-18,28-30H,4,7-8H2/b22-17+
InChIKey SMMDLKRXPIRZEF-OQKWZONESA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_3058
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: 120052; Labnumber: GELNCE-037; VK_ID: VK-003059
Synonyms 9-[4-(difluoromethoxy)benzylidene]-5-[4-(difluoromethoxy)phenyl]-3-phenyl-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Temperature 305 °C