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Tetrazole, 1-(2-fluorophenyl)-5-[4-(1,1-dimethylethyl)benzylthio]-
SpectraBase Compound ID 1iecHKtc0Nj
InChI InChI=1S/C18H19FN4S/c1-18(2,3)14-10-8-13(9-11-14)12-24-17-20-21-22-23(17)16-7-5-4-6-15(16)19/h4-11H,12H2,1-3H3
InChIKey WMIZTUQKVAYYJT-UHFFFAOYSA-N
Mol Weight 342.44 g/mol
Molecular Formula C18H19FN4S
Exact Mass 342.131446 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LDbdS6pUDAG
Name Tetrazole, 1-(2-fluorophenyl)-5-[4-(1,1-dimethylethyl)benzylthio]-
Alternate Name(s) 4-tert-Butylbenzyl 1-(2-fluorophenyl)-1H-tetraazol-5-yl sulfide 5-[(4-tert-Butylbenzyl)sulfanyl]-1-(2-fluorophenyl)-1H-tetraazole 5-[(4-tert-butylbenzyl)thio]-1-(2-fluorophenyl)tetrazole 5-[(4-tert-butylphenyl)methylsulfanyl]-1-(2-fluorophenyl)-1,2,3,4-tetrazole 5-[(4-tert-butylphenyl)methylsulfanyl]-1-(2-fluorophenyl)tetrazole 5-[(4-tert-butylphenyl)methylthio]-1-(2-fluorophenyl)tetrazole
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Formula C18H19FN4S
InChI InChI=1S/C18H19FN4S/c1-18(2,3)14-10-8-13(9-11-14)12-24-17-20-21-22-23(17)16-7-5-4-6-15(16)19/h4-11H,12H2,1-3H3
InChIKey WMIZTUQKVAYYJT-UHFFFAOYSA-N
Molecular Weight 342.436 g/mol
SMILES c1ccc(-[n]2c(nnn2)SCc2ccc(C(C)(C)C)cc2)c(F)c1
SPLASH splash10-000t-3910000000-d2155be0745af0c1a07c
Source of Spectrum AD-0-2532-0
Wiley ID 1433568