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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-6-[[3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]phenyl]methylene]-2-(1-methylethyl)-, (6Z)-
SpectraBase Compound ID A6RReT1aCat
InChI InChI=1S/C24H23N5O6S/c1-14(2)23-27-28-21(25)18(22(30)26-24(28)36-23)12-15-4-9-19(20(13-15)33-3)35-11-10-34-17-7-5-16(6-8-17)29(31)32/h4-9,12-14,25H,10-11H2,1-3H3/b18-12-,25-21?
InChIKey IMQCIVHHRCJOJB-JLFKZYKSSA-N
Mol Weight 509.54 g/mol
Molecular Formula C24H23N5O6S
Exact Mass 509.136905 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1LO9ITa16jP
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-6-[[3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]phenyl]methylene]-2-(1-methylethyl)-, (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 509.136904649 u
Formula C24H23N5O6S
InChI InChI=1S/C24H23N5O6S/c1-14(2)23-27-28-21(25)18(22(30)26-24(28)36-23)12-15-4-9-19(20(13-15)33-3)35-11-10-34-17-7-5-16(6-8-17)29(31)32/h4-9,12-14,25H,10-11H2,1-3H3/b18-12-,25-21?
InChIKey IMQCIVHHRCJOJB-JLFKZYKSSA-N
Molecular Weight 509.537 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12660
Solvent DMSO-d6
Source Vendor ID: ZI/10030524; Lab Info: CEP; Lab Number: CEP-6700607