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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-[2-(2-propenyl)phenoxy]ethoxy]phenyl]methylene]-2-(1-methylethyl)-,
SpectraBase Compound ID K5OOFSseriU
InChI InChI=1S/C27H28N4O4S/c1-5-8-19-9-6-7-10-21(19)34-13-14-35-22-12-11-18(16-23(22)33-4)15-20-24(28)31-27(29-25(20)32)36-26(30-31)17(2)3/h5-7,9-12,15-17,28H,1,8,13-14H2,2-4H3/b20-15-,28-24?
InChIKey JLSGHSHBDFRSDS-NJIOILOSSA-N
Mol Weight 504.61 g/mol
Molecular Formula C27H28N4O4S
Exact Mass 504.183127 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2rwDszp87ga
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-6-[[3-methoxy-4-[2-[2-(2-propenyl)phenoxy]ethoxy]phenyl]methylene]-2-(1-methylethyl)-,
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 504.183126568 u
Formula C27H28N4O4S
InChI InChI=1S/C27H28N4O4S/c1-5-8-19-9-6-7-10-21(19)34-13-14-35-22-12-11-18(16-23(22)33-4)15-20-24(28)31-27(29-25(20)32)36-26(30-31)17(2)3/h5-7,9-12,15-17,28H,1,8,13-14H2,2-4H3/b20-15-,28-24?
InChIKey JLSGHSHBDFRSDS-NJIOILOSSA-N
Molecular Weight 504.605 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17070
Solvent DMSO-d6
Source Vendor ID: ZI/10032711; Lab Info: CEP; Lab Number: CEP-6700563