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Methyl 4-(3'-phenylseleno-4'-(p-toluenesulfonyl)butoxy benzoate
SpectraBase Compound ID BuXEOSEhSaG
InChI InChI=1S/C25H26O5SSe/c1-19-8-14-22(15-9-19)31(27,28)18-24(32-23-6-4-3-5-7-23)16-17-30-21-12-10-20(11-13-21)25(26)29-2/h3-15,24H,16-18H2,1-2H3
InChIKey QQHBVMNRXZMCGE-UHFFFAOYSA-N
Mol Weight 517.51 g/mol
Molecular Formula C25H26O5SSe
Exact Mass 518.066617 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Glv2u1opHfD
Name Methyl 4-(3'-phenylseleno-4'-(p-toluenesulfonyl)butoxy benzoate
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Formula C25H26O5SSe
InChI InChI=1S/C25H26O5SSe/c1-19-8-14-22(15-9-19)31(27,28)18-24(32-23-6-4-3-5-7-23)16-17-30-21-12-10-20(11-13-21)25(26)29-2/h3-15,24H,16-18H2,1-2H3
InChIKey QQHBVMNRXZMCGE-UHFFFAOYSA-N
Molecular Weight 517.510 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)C([Se]c1ccccc1)CCOc1ccc(C(=O)OC)cc1
SPLASH splash10-0a4i-0093020000-6e6a8080e5c41e848be6
Source of Spectrum SK-23-3557-2
Synonyms 4-[4-(4-methylphenyl)sulfonyl-3-(phenylseleno)butoxy]benzoic acid methyl ester Methyl 4-[4-(4-methylphenyl)sulfonyl-3-phenylselanylbutoxy]benzoate Methyl 4-[3-phenylselanyl-4-(p-tolylsulfonyl)butoxy]benzoate Methyl 4-[4-(4-methylphenyl)sulfonyl-3-phenylselanyl-butoxy]benzoate
Wiley ID 865801