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Methoxycarbonylmethyltriphenylphosphonium p-toluenesulfonate
SpectraBase Compound ID FLfELpfWlZp
InChI InChI=1S/C28H27O5PS/c1-23-18-20-27(21-19-23)35(30,31)33-34(22-28(29)32-2,24-12-6-3-7-13-24,25-14-8-4-9-15-25)26-16-10-5-11-17-26/h3-21H,22H2,1-2H3
InChIKey ZBCNJDMKLINIFM-UHFFFAOYSA-N
Mol Weight 506.55 g/mol
Molecular Formula C28H27O5PS
Exact Mass 506.131682 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C8n3Jivdj3B
Name Methoxycarbonylmethyltriphenylphosphonium p-toluenesulfonate
Alternate Name(s) Methyl[{[(4-methylphenyl)sulfonyl]oxy}(triphenyl)phosphoranyl]acetate
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Formula C28H27O5PS
InChI InChI=1S/C28H27O5PS/c1-23-18-20-27(21-19-23)35(30,31)33-34(22-28(29)32-2,24-12-6-3-7-13-24,25-14-8-4-9-15-25)26-16-10-5-11-17-26/h3-21H,22H2,1-2H3
InChIKey ZBCNJDMKLINIFM-UHFFFAOYSA-N
Molecular Weight 506.553 g/mol
SMILES c1(P(c2ccccc2)(c2ccccc2)(CC(=O)OC)OS(c2ccc(cc2)C)(=O)=O)ccccc1
SPLASH splash10-0fb9-9880000000-e4977a30c4e86f8c0a47
Source of Spectrum F-56-7899-2
Wiley ID 858775