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Propanol, 3-[4-(2,4-dichlorophenyl)-5-methylthio-1,2,4-triazol-3-yl]-
SpectraBase Compound ID K0IZ7N1yJDk
InChI InChI=1S/C12H13Cl2N3OS/c1-19-12-16-15-11(3-2-6-18)17(12)10-5-4-8(13)7-9(10)14/h4-5,7,18H,2-3,6H2,1H3
InChIKey YLPXEPUKLLZFQG-UHFFFAOYSA-N
Mol Weight 318.22 g/mol
Molecular Formula C12H13Cl2N3OS
Exact Mass 317.015639 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LDa1JyHrSP1
Name Propanol, 3-[4-(2,4-dichlorophenyl)-5-methylthio-1,2,4-triazol-3-yl]-
Alternate Name(s) 3-[4-(2,4-Dichlorophenyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-1-propanol 3-[4-(2,4-dichlorophenyl)-5-(methylthio)-1,2,4-triazol-3-yl]-1-propanol 3-[4-(2,4-dichlorophenyl)-5-(methylthio)-1,2,4-triazol-3-yl]propan-1-ol 3-[4-(2,4-dichlorophenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]propan-1-ol
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Formula C12H13Cl2N3OS
InChI InChI=1S/C12H13Cl2N3OS/c1-19-12-16-15-11(3-2-6-18)17(12)10-5-4-8(13)7-9(10)14/h4-5,7,18H,2-3,6H2,1H3
InChIKey YLPXEPUKLLZFQG-UHFFFAOYSA-N
Molecular Weight 318.222 g/mol
SMILES OCCCc1nnc([n]1-c1c(cc(cc1)Cl)Cl)SC
SPLASH splash10-0fg9-2490000000-166d248a3e10555adee7
Source of Spectrum AD-0-2532-0
Wiley ID 1425830