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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 2-butyl-6-[[4-[2-(2,4-dimethylphenoxy)ethoxy]phenyl]methylene]-5,6-dihydro-5-imino-, (6Z)-
SpectraBase Compound ID 5pNL3DEBwCb
InChI InChI=1S/C26H28N4O3S/c1-4-5-6-23-29-30-24(27)21(25(31)28-26(30)34-23)16-19-8-10-20(11-9-19)32-13-14-33-22-12-7-17(2)15-18(22)3/h7-12,15-16,27H,4-6,13-14H2,1-3H3/b21-16-,27-24?
InChIKey AICXFSFVCWBKII-FWMAWXJYSA-N
Mol Weight 476.6 g/mol
Molecular Formula C26H28N4O3S
Exact Mass 476.188212 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID COPdlvR3mhD
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 2-butyl-6-[[4-[2-(2,4-dimethylphenoxy)ethoxy]phenyl]methylene]-5,6-dihydro-5-imino-, (6Z)-
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/C26H28N4O3S/c1-4-5-6-23-29-30-24(27)21(25(31)28-26(30)34-23)16-19-8-10-20(11-9-19)32-13-14-33-22-12-7-17(2)15-18(22)3/h7-12,15-16,27H,4-6,13-14H2,1-3H3/b21-16-,27-24?
InChIKey AICXFSFVCWBKII-FWMAWXJYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2500
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: NMR/11269156