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5-(1-ADAMANTYL)-4-(4-METHOXYBENZYLIDENEAMINO)-3-MERCAPTO-1,2,4-TRIAZOLE
SpectraBase Compound ID 7n8rokoKzUD
InChI InChI=1S/C20H24N4OS/c1-25-17-4-2-13(3-5-17)12-21-24-18(22-23-19(24)26)20-9-14-6-15(10-20)8-16(7-14)11-20/h2-5,12,14-16H,6-11H2,1H3,(H,23,26)/b21-12+/t14-,15+,16-,20-
InChIKey HPXLWYCOLBSJPS-RIKUCMEGSA-N
Mol Weight 368.5 g/mol
Molecular Formula C20H24N4OS
Exact Mass 368.167083 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FeKYBoWxQxo
Name 5-(1-ADAMANTYL)-4-(4-METHOXYBENZYLIDENEAMINO)-3-MERCAPTO-1,2,4-TRIAZOLE
Compound Number 6K
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H24N4OS
InChI InChI=1S/C20H24N4OS/c1-25-17-4-2-13(3-5-17)12-21-24-18(22-23-19(24)26)20-9-14-6-15(10-20)8-16(7-14)11-20/h2-5,12,14-16H,6-11H2,1H3,(H,23,26)/b21-12+/t14-,15+,16-,20-
InChIKey HPXLWYCOLBSJPS-RIKUCMEGSA-N
Literature Reference Author M.A.AL-OMAR,E.S.AL-ABDULLAH,I.A.SHEHATA,E.E.HABIB,T.M.IBRAHI M,A.A.EL-EMAM
Literature Reference Citation MOLECULES,15,2526(2010)
Literature Reference DOI 10.3390/molecules15042526
Molecular Weight 368.497 g/mol
Sample ID 70279
Solvent Unknown