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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-2-(1-methylethyl)-6-[[4-(phenylmethoxy)phenyl]methylene]-, (6Z)-
SpectraBase Compound ID FuiQtAWRsK7
InChI InChI=1S/C22H20N4O2S/c1-14(2)21-25-26-19(23)18(20(27)24-22(26)29-21)12-15-8-10-17(11-9-15)28-13-16-6-4-3-5-7-16/h3-12,14,23H,13H2,1-2H3/b18-12-,23-19?
InChIKey WZFNDFXHVUFCCR-BIWIXZEJSA-N
Mol Weight 404.49 g/mol
Molecular Formula C22H20N4O2S
Exact Mass 404.130697 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4FKUzIaCZhr
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-2-(1-methylethyl)-6-[[4-(phenylmethoxy)phenyl]methylene]-, (6Z)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 404.130697072 u
Formula C22H20N4O2S
InChI InChI=1S/C22H20N4O2S/c1-14(2)21-25-26-19(23)18(20(27)24-22(26)29-21)12-15-8-10-17(11-9-15)28-13-16-6-4-3-5-7-16/h3-12,14,23H,13H2,1-2H3/b18-12-,23-19?
InChIKey WZFNDFXHVUFCCR-BIWIXZEJSA-N
Molecular Weight 404.488 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17018
Solvent DMSO-d6
Source Vendor ID: ZI/10031184; Lab Info: CEP; Lab Number: CEP-6700116