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ethanone, 1-(9H-fluoren-2-yl)-2-[[5-(2-furanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

ethanone, 1-(9H-fluoren-2-yl)-2-[[5-(2-furanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-
SpectraBase Compound ID IoK4vATeg7h
InChI InChI=1S/C27H19N3O2S/c31-24(19-12-13-23-20(16-19)15-18-7-4-5-10-22(18)23)17-33-27-29-28-26(25-11-6-14-32-25)30(27)21-8-2-1-3-9-21/h1-14,16H,15,17H2
InChIKey YDRZYKMYBIVNJX-UHFFFAOYSA-N
Mol Weight 449.53 g/mol
Molecular Formula C27H19N3O2S
Exact Mass 449.119798 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K16BDj4zPXS
Name 1-(9H-fluoren-2-yl)-2-[[5-(2-furanyl)-4-phenyl-1,2,4-triazol-3-yl]thio]ethanone
Alternate Name(s) 1-(9H-fluoren-2-yl)-2-[[5-(2-furyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanone 1-(9H-fluoren-2-yl)-2-[[5-(2-furyl)-4-phenyl-1,2,4-triazol-3-yl]thio]ethanone 1-(9H-fluoren-2-yl)-2-[[5-(furan-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanone
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Formula C27H19N3O2S
InChI InChI=1S/C27H19N3O2S/c31-24(19-12-13-23-20(16-19)15-18-7-4-5-10-22(18)23)17-33-27-29-28-26(25-11-6-14-32-25)30(27)21-8-2-1-3-9-21/h1-14,16H,15,17H2
InChIKey YDRZYKMYBIVNJX-UHFFFAOYSA-N
Molecular Weight 449.528 g/mol
SMILES c1ccc(-[n]2c(nnc2SCC(c2cc3Cc4ccccc4-c3cc2)=O)-c2occc2)cc1
SPLASH splash10-0006-1900100000-9e634238e4ade68bb7b0
Wiley ID 1459931