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4-Bromobenzyl 1-(2,6-dimethylphenyl)-1H-tetraazol-5-yl sulfide
SpectraBase Compound ID 9IdJHgamOTI
InChI InChI=1S/C16H15BrN4S/c1-11-4-3-5-12(2)15(11)21-16(18-19-20-21)22-10-13-6-8-14(17)9-7-13/h3-9H,10H2,1-2H3
InChIKey QKISJTQTJLLEOC-UHFFFAOYSA-N
Mol Weight 375.29 g/mol
Molecular Formula C16H15BrN4S
Exact Mass 374.020081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I69rYPZu3T9
Name 4-Bromobenzyl 1-(2,6-dimethylphenyl)-1H-tetraazol-5-yl sulfide
CAS Registry Number 282719-16-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15BrN4S
InChI InChI=1S/C16H15BrN4S/c1-11-4-3-5-12(2)15(11)21-16(18-19-20-21)22-10-13-6-8-14(17)9-7-13/h3-9H,10H2,1-2H3
InChIKey QKISJTQTJLLEOC-UHFFFAOYSA-N
Molecular Weight 375.288 g/mol
SMILES Cc1c(-[n]2c(nnn2)SCc2ccc(cc2)Br)c(ccc1)C
SPLASH splash10-00xs-7900000000-3c6e87f02b726033ea1a
Source of Spectrum AD-0-2532-0
Synonyms 5-[(4-Bromobenzyl)thio]-1-(2,6-dimethylphenyl)-1H-1,2,3,4-tetrazole 5-[(4-bromobenzyl)thio]-1-(2,6-dimethylphenyl)tetrazole 5-[(4-bromophenyl)methylsulfanyl]-1-(2,6-dimethylphenyl)-1,2,3,4-tetrazole 5-[(4-bromophenyl)methylsulfanyl]-1-(2,6-dimethylphenyl)tetrazole 5-[(4-bromophenyl)methylthio]-1-(2,6-dimethylphenyl)tetrazole
Wiley ID 1433435