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2,2-bis[4-(2,3-dimercaptopropoxy)phenyl]propane
SpectraBase Compound ID J6JAEEKQFfP
InChI InChI=1S/C21H28O2S4/c1-21(2,15-3-7-17(8-4-15)22-11-19(26)13-24)16-5-9-18(10-6-16)23-12-20(27)14-25/h3-10,19-20,24-27H,11-14H2,1-2H3
InChIKey RMOXHCXXNWCYHH-UHFFFAOYSA-N
Mol Weight 440.7 g/mol
Molecular Formula C21H28O2S4
Exact Mass 440.097215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GH4sPIO0JJG
Name 2,2-bis[4-(2,3-dimercaptopropoxy)phenyl]propane
Appearance Colorless solid
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Formula C21H28O2S4
InChI InChI=1S/C21H28O2S4/c1-21(2,15-3-7-17(8-4-15)22-11-19(26)13-24)16-5-9-18(10-6-16)23-12-20(27)14-25/h3-10,19-20,24-27H,11-14H2,1-2H3
InChIKey RMOXHCXXNWCYHH-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 440.693 g/mol
SMILES SCC(COc1ccc(C(c2ccc(OCC(CS)S)cc2)(C)C)cc1)S
SPLASH splash10-03di-0090000000-996d85734ceec19eb60b
Source of Spectrum WO2015124797A1
Wiley ID 1850642