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(6-chloro-4H-1,3-benzodioxin-8-yl)methyl 1-phenyl-1H-tetraazol-5-yl sulfide
SpectraBase Compound ID 8gBEXTBSwEw
InChI InChI=1S/C16H13ClN4O2S/c17-13-6-11-8-22-10-23-15(11)12(7-13)9-24-16-18-19-20-21(16)14-4-2-1-3-5-14/h1-7H,8-10H2
InChIKey BYCJVRDVACUILT-UHFFFAOYSA-N
Mol Weight 360.82 g/mol
Molecular Formula C16H13ClN4O2S
Exact Mass 360.044775 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J19VRaG3oo0
Name (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 1-phenyl-1H-tetraazol-5-yl sulfide
Alternate Name(s) 5-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1-phenyl-1,2,3,4-tetrazole 5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1-phenyl-tetrazole 5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-1-phenyl-tetrazole 5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-1-phenyltetrazole
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Formula C16H13ClN4O2S
InChI InChI=1S/C16H13ClN4O2S/c17-13-6-11-8-22-10-23-15(11)12(7-13)9-24-16-18-19-20-21(16)14-4-2-1-3-5-14/h1-7H,8-10H2
InChIKey BYCJVRDVACUILT-UHFFFAOYSA-N
Molecular Weight 360.819 g/mol
SMILES c1ccc(-[n]2c(nnn2)SCc2c3c(COCO3)cc(c2)Cl)cc1
SPLASH splash10-0fbi-9500000000-bd15aa852bfaea1c4b3a
Wiley ID 1452064