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3-(p-Chlorophenyl)-5-(.beta.-hydroxyethylmercapto)-s-triazole
SpectraBase Compound ID LNDm5KGB7Kr
InChI InChI=1S/C10H10ClN3OS/c11-8-3-1-7(2-4-8)9-12-10(14-13-9)16-6-5-15/h1-4,15H,5-6H2,(H,12,13,14)
InChIKey DAWRYGBXYYQKBX-UHFFFAOYSA-N
Mol Weight 255.72 g/mol
Molecular Formula C10H10ClN3OS
Exact Mass 255.023311 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4CtMKWpODxB
Name 3-(p-Chlorophenyl)-5-(.beta.-hydroxyethylmercapto)-s-triazole
Alternate Name(s) 2-{[3-(4-chlorophenyl)-1H-1,2,4-triazol-5-yl]sulfanyl}ethanol
Comments Less than 3 mono-isotopic peaks
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Formula C10H10ClN3OS
InChI InChI=1S/C10H10ClN3OS/c11-8-3-1-7(2-4-8)9-12-10(14-13-9)16-6-5-15/h1-4,15H,5-6H2,(H,12,13,14)
InChIKey DAWRYGBXYYQKBX-UHFFFAOYSA-N
Molecular Weight 255.723 g/mol
SMILES [nH]1nc(nc1SCCO)-c1ccc(cc1)Cl
SPLASH splash10-0a4i-0090000000-e2d24f286e735f8b818e
Source of Spectrum Y1-33-640-15
Wiley ID 1526367