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2-THIONE-3(N)-[(2'-METHOXY-6'-CHLORO)-9'-ACRIDINYL]-5-ETHYLTHIO-1,3,4-THIADIAZOLE
SpectraBase Compound ID Jf7vbAgIs6W
InChI InChI=1S/C18H14ClN3OS3/c1-3-25-17-21-22(18(24)26-17)16-12-6-4-10(19)8-15(12)20-14-7-5-11(23-2)9-13(14)16/h4-9H,3H2,1-2H3
InChIKey LPHQUHGFTFQFCN-UHFFFAOYSA-N
Mol Weight 419.96 g/mol
Molecular Formula C18H14ClN3OS3
Exact Mass 418.998753 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID s4FrHyrvgR
Name 2-THIONE-3(N)-[(2'-METHOXY-6'-CHLORO)-9'-ACRIDINYL]-5-ETHYLTHIO-1,3,4-THIADIAZOLE
Compound Number 7F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H14ClN3OS3
InChI InChI=1S/C18H14ClN3OS3/c1-3-25-17-21-22(18(24)26-17)16-12-6-4-10(19)8-15(12)20-14-7-5-11(23-2)9-13(14)16/h4-9H,3H2,1-2H3
InChIKey LPHQUHGFTFQFCN-UHFFFAOYSA-N
Literature Reference Author P.AMIEL,A.MAHAMOUD,P.BROUANT,J.P.GALY,J.BARBE,J.KAROLAK-WOJC IECHOWSKA,M.POSEL
Literature Reference Citation CAN.J.CHEM.,73,1258(1995)
Literature Reference DOI 10.1139/v95-154
Molecular Weight 419.962 g/mol
Solvent CF3COOD
Source File Reference UWRK991