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2-[4-tert-butyl-5-(4-nitrophenyl)-2-phenyl-3H-1,2,4-triazol-3-yl]ethynyl-trimethyl-silane
SpectraBase Compound ID HNERSxFScu7
InChI InChI=1S/C23H28N4O2Si/c1-23(2,3)25-21(16-17-30(4,5)6)26(19-10-8-7-9-11-19)24-22(25)18-12-14-20(15-13-18)27(28)29/h7-15,21H,1-6H3
InChIKey JICQSKXIDGRCQW-UHFFFAOYSA-N
Mol Weight 420.59 g/mol
Molecular Formula C23H28N4O2Si
Exact Mass 420.198153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nGU9FCz0S
Name 2-[4-tert-butyl-5-(4-nitrophenyl)-2-phenyl-3H-1,2,4-triazol-3-yl]ethynyl-trimethyl-silane
Alternate Name(s) 4-tert-Butyl-3-(4-nitrophenyl)-1-phenyl-5-[(trimethylsilyl)ethynyl]-4,5-dihydro-1H-1,2,4-triazole
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Formula C23H28N4O2Si
InChI InChI=1S/C23H28N4O2Si/c1-23(2,3)25-21(16-17-30(4,5)6)26(19-10-8-7-9-11-19)24-22(25)18-12-14-20(15-13-18)27(28)29/h7-15,21H,1-6H3
InChIKey JICQSKXIDGRCQW-UHFFFAOYSA-N
Molecular Weight 420.588 g/mol
SMILES c1ccc(N2C(N(C(=N2)c2ccc(N(=O)=O)cc2)C(C)(C)C)C#C[Si](C)(C)C)cc1
SPLASH splash10-03dl-9116000000-62d746523ce37aa5a7cb
Wiley ID 1455151