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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 2-cyclohexyl-6-[(3-ethoxy-4-hydroxyphenyl)methylene]-5,6-dihydro-5-imino-, (6Z)-
SpectraBase Compound ID Cws4tArCOes
InChI InChI=1S/C20H22N4O3S/c1-2-27-16-11-12(8-9-15(16)25)10-14-17(21)24-20(22-18(14)26)28-19(23-24)13-6-4-3-5-7-13/h8-11,13,21,25H,2-7H2,1H3/b14-10-,21-17?
InChIKey XLNBBNFEDUQVQV-QBILMKHKSA-N
Mol Weight 398.48 g/mol
Molecular Formula C20H22N4O3S
Exact Mass 398.141262 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 79KuEkvhU7c
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 2-cyclohexyl-6-[(3-ethoxy-4-hydroxyphenyl)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/C20H22N4O3S/c1-2-27-16-11-12(8-9-15(16)25)10-14-17(21)24-20(22-18(14)26)28-19(23-24)13-6-4-3-5-7-13/h8-11,13,21,25H,2-7H2,1H3/b14-10-,21-17?
InChIKey XLNBBNFEDUQVQV-QBILMKHKSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_277
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/10318770