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(E)-6-hydroxy-6,6-diphenyl-3-hexenedithioic acid propan-2-yl ester
SpectraBase Compound ID 2pDWM8HiCmQ
InChI InChI=1S/C21H24OS2/c1-17(2)24-20(23)15-9-10-16-21(22,18-11-5-3-6-12-18)19-13-7-4-8-14-19/h3-14,17,22H,15-16H2,1-2H3/b10-9+
InChIKey RKWSHHLQJLDPND-MDZDMXLPSA-N
Mol Weight 356.54 g/mol
Molecular Formula C21H24OS2
Exact Mass 356.126858 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5qiEkro6qC7
Name (E)-6-hydroxy-6,6-diphenyl-3-hexenedithioic acid propan-2-yl ester
Alternate Name(s) (E)-6-hydroxy-6,6-diphenyl-hex-3-enedithioic acid isopropyl ester 3-Hexenedithioic acid, 6-hydroxy-6,6-diphenyl-, 1-methylethyl ester Isopropyl (3E)-6-hydroxy-6,6-diphenyl-3-hexenedithioate isopropyl (E)-6-hydroxy-6,6-diphenyl-hex-3-enedithioate Propan-2-yl (E)-6-hydroxy-6,6-diphenylhex-3-enedithioate Propan-2-yl (E)-6-oxidanyl-6,6-diphenyl-hex-3-enedithioate
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Formula C21H24OS2
InChI InChI=1S/C21H24OS2/c1-17(2)24-20(23)15-9-10-16-21(22,18-11-5-3-6-12-18)19-13-7-4-8-14-19/h3-14,17,22H,15-16H2,1-2H3/b10-9+
InChIKey RKWSHHLQJLDPND-MDZDMXLPSA-N
Molecular Weight 356.542 g/mol
SMILES OC(c1ccccc1)(c1ccccc1)C\C=C\CC(=S)SC(C)C
SPLASH splash10-053r-4910000000-c6b436e9d23ec91c04ca
Wiley ID 1477248