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2-Benzyl-2-[3-(phenylseleno)-4-tosyl-butyl]malonic acid dimethyl ester
SpectraBase Compound ID GTryZspCBaC
InChI InChI=1S/C29H32O6SSe/c1-22-14-16-24(17-15-22)36(32,33)21-26(37-25-12-8-5-9-13-25)18-19-29(27(30)34-2,28(31)35-3)20-23-10-6-4-7-11-23/h4-17,26H,18-21H2,1-3H3
InChIKey BEOFPBHTLKQJLQ-UHFFFAOYSA-N
Mol Weight 587.6 g/mol
Molecular Formula C29H32O6SSe
Exact Mass 588.108482 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8AdlFna8VPv
Name 2-Benzyl-2-[3-(phenylseleno)-4-tosyl-butyl]malonic acid dimethyl ester
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Formula C29H32O6SSe
InChI InChI=1S/C29H32O6SSe/c1-22-14-16-24(17-15-22)36(32,33)21-26(37-25-12-8-5-9-13-25)18-19-29(27(30)34-2,28(31)35-3)20-23-10-6-4-7-11-23/h4-17,26H,18-21H2,1-3H3
InChIKey BEOFPBHTLKQJLQ-UHFFFAOYSA-N
Molecular Weight 587.601 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)C([Se]c1ccccc1)CCC(C(=O)OC)(C(=O)OC)Cc1ccccc1
SPLASH splash10-0006-9000000000-c7bd39dcf420d0bb141b
Source of Spectrum SK-23-3557-2
Synonyms 2-[4-(4-methylphenyl)sulfonyl-3-(phenylseleno)butyl]-2-(phenylmethyl)propanedioic acid dimethyl ester Dimethyl 2-benzyl-2-[3-phenylselanyl-4-(p-tolylsulfonyl)butyl]propanedioate Dimethyl 2-benzyl-2-[4-(4-methylphenyl)sulfonyl-3-phenylselanylbutyl]propanedioate Dimethyl 2-[4-(4-methylphenyl)sulfonyl-3-phenylselanyl-butyl]-2-(phenylmethyl)propanedioate
Wiley ID 865802