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(6Z)-6-(3-ethoxy-4-hydroxybenzylidene)-5-imino-3-(isobutylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one

View entire compound with spectra: 1 NMR

(6Z)-6-(3-ethoxy-4-hydroxybenzylidene)-5-imino-3-(isobutylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
SpectraBase Compound ID 6036qlFRc7
InChI InChI=1S/C18H20N4O3S2/c1-4-25-14-8-11(5-6-13(14)23)7-12-15(19)22-17(20-16(12)24)27-21-18(22)26-9-10(2)3/h5-8,10,19,23H,4,9H2,1-3H3/b12-7-,19-15?
InChIKey WPFJYGCOXXVITC-AQINLTQESA-N
Mol Weight 404.5 g/mol
Molecular Formula C18H20N4O3S2
Exact Mass 404.097683 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 74e1HgGFYxq
Name (6Z)-6-(3-ethoxy-4-hydroxybenzylidene)-5-imino-3-(isobutylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 404.097682865 u
Formula C18H20N4O3S2
InChI InChI=1S/C18H20N4O3S2/c1-4-25-14-8-11(5-6-13(14)23)7-12-15(19)22-17(20-16(12)24)27-21-18(22)26-9-10(2)3/h5-8,10,19,23H,4,9H2,1-3H3/b12-7-,19-15?
InChIKey WPFJYGCOXXVITC-AQINLTQESA-N
Molecular Weight 404.503 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_193
Solvent DMSO-d6
Source Vendor ID: NMR/12259851