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1-(2-Methyl-2-hydroxy-3-[1,2,4]triazol-1-yl)propyl-2-benzylthio-4-methylimidazole
SpectraBase Compound ID j63JYRPXjr
InChI InChI=1S/C17H21N5OS/c1-14-8-21(10-17(2,23)11-22-13-18-12-19-22)16(20-14)24-9-15-6-4-3-5-7-15/h3-8,12-13,23H,9-11H2,1-2H3
InChIKey CTDRDANHDQLOEU-UHFFFAOYSA-N
Mol Weight 343.45 g/mol
Molecular Formula C17H21N5OS
Exact Mass 343.146681 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6rpkic50hEQ
Name 1-(2-Methyl-2-hydroxy-3-[1,2,4]triazol-1-yl)propyl-2-benzylthio-4-methylimidazole
Comments Less than 3 mono-isotopic peaks
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Formula C17H21N5OS
InChI InChI=1S/C17H21N5OS/c1-14-8-21(10-17(2,23)11-22-13-18-12-19-22)16(20-14)24-9-15-6-4-3-5-7-15/h3-8,12-13,23H,9-11H2,1-2H3
InChIKey CTDRDANHDQLOEU-UHFFFAOYSA-N
Molecular Weight 343.449 g/mol
SMILES OC(C[n]1c(nc(C)c1)SCc1ccccc1)(C[n]1ncnc1)C
SPLASH splash10-0006-0109000000-4363e4f52d4dd21f9c4a
Source of Spectrum SO-0-1619-23
Synonyms 1-[2-(benzylsulfanyl)-4-methyl-1H-imidazol-1-yl]-2-methyl-3-(1H-1,2,4-triazol-1-yl)-2-propanol
Wiley ID 876918