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(2-(p-Chlorophenylhydroxymethyl)-1,2-diphenylvinyl)-n-butylphenylphosphine sulfide
SpectraBase Compound ID 85p0mcaG8Hd
InChI InChI=1S/C31H30ClOPS/c1-2-3-23-34(35,28-17-11-6-12-18-28)31(26-15-9-5-10-16-26)29(24-13-7-4-8-14-24)30(33)25-19-21-27(32)22-20-25/h4-22,30,33H,2-3,23H2,1H3/b31-29-
InChIKey IKKRGXVIAKDRHP-YCNYHXFESA-N
Mol Weight 517.07 g/mol
Molecular Formula C31H30ClOPS
Exact Mass 516.144351 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID vxGTozhvsE
Name (2-(p-Chlorophenylhydroxymethyl)-1,2-diphenylvinyl)-n-butylphenylphosphine sulfide
CAS Registry Number 96845-07-7
Comments Less than 3 mono-isotopic peaks
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Formula C31H30ClOPS
InChI InChI=1S/C31H30ClOPS/c1-2-3-23-34(35,28-17-11-6-12-18-28)31(26-15-9-5-10-16-26)29(24-13-7-4-8-14-24)30(33)25-19-21-27(32)22-20-25/h4-22,30,33H,2-3,23H2,1H3/b31-29-
InChIKey IKKRGXVIAKDRHP-YCNYHXFESA-N
Molecular Weight 517.067 g/mol
SMILES OC(\C(=C\(P(=S)(c1ccccc1)CCCC)c1ccccc1)c1ccccc1)c1ccc(cc1)Cl
SPLASH splash10-00kb-0900060000-d8cc0d31f0f9810da750
Source of Spectrum C-107-4706-0
Synonyms (2Z)-3-[butyl(phenyl)phosphorothioyl]-1-(4-chlorophenyl)-2,3-diphenyl-2-propen-1-ol
Wiley ID 1401455