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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[2-(3,5-dimethylphenoxy)ethoxy]-3-ethoxyphenyl]methylene]-5,6-dihydro-5-imino-2-methyl-, (6Z)-
SpectraBase Compound ID 7cDwWJxBuQK
InChI InChI=1S/C25H26N4O4S/c1-5-31-22-14-18(13-20-23(26)29-25(27-24(20)30)34-17(4)28-29)6-7-21(22)33-9-8-32-19-11-15(2)10-16(3)12-19/h6-7,10-14,26H,5,8-9H2,1-4H3/b20-13-,26-23?
InChIKey XDVIOCVSGOIDQY-ZQCYNNBZSA-N
Mol Weight 478.57 g/mol
Molecular Formula C25H26N4O4S
Exact Mass 478.167477 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4gYsnAkoEd3
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[2-(3,5-dimethylphenoxy)ethoxy]-3-ethoxyphenyl]methylene]-5,6-dihydro-5-imino-2-methyl-, (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/C25H26N4O4S/c1-5-31-22-14-18(13-20-23(26)29-25(27-24(20)30)34-17(4)28-29)6-7-21(22)33-9-8-32-19-11-15(2)10-16(3)12-19/h6-7,10-14,26H,5,8-9H2,1-4H3/b20-13-,26-23?
InChIKey XDVIOCVSGOIDQY-ZQCYNNBZSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2589
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/11269262