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1-(2-Methylsulfanylbenzoyl)ethylidene(triphenyl)phosphorane
SpectraBase Compound ID B30Pi9H5iWo
InChI InChI=1S/C28H25OPS/c1-22(28(29)26-20-12-13-21-27(26)31-2)30(23-14-6-3-7-15-23,24-16-8-4-9-17-24)25-18-10-5-11-19-25/h3-21H,1-2H3
InChIKey LQQCAAFWTMPUMB-UHFFFAOYSA-N
Mol Weight 440.54 g/mol
Molecular Formula C28H25OPS
Exact Mass 440.136374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2KvWGXICDHX
Name 1-(2-Methylsulfanylbenzoyl)ethylidene(triphenyl)phosphorane
Alternate Name(s) 1-[2-(methylsulfanyl)phenyl]-2-(triphenylphosphoranylidene)-1-propanone 1-[2-(methylthio)phenyl]-2-triphenylphosphoranylidene-1-propanone 1-(2-Methylsulfanylphenyl)-2-(triphenyl-$l^{5}-phosphanylidene)propan-1-one
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Formula C28H25OPS
InChI InChI=1S/C28H25OPS/c1-22(28(29)26-20-12-13-21-27(26)31-2)30(23-14-6-3-7-15-23,24-16-8-4-9-17-24)25-18-10-5-11-19-25/h3-21H,1-2H3
InChIKey LQQCAAFWTMPUMB-UHFFFAOYSA-N
Molecular Weight 440.541 g/mol
SMILES C(=P(c1ccccc1)(c1ccccc1)c1ccccc1)(C(c1c(SC)cccc1)=O)C
SPLASH splash10-02wc-5350900000-7b7415184f3e03e2ea10
Source of Spectrum KC-0-2458-2
Wiley ID 782083