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2-[2-(tosylmethyl)allyl]malonic acid dimethyl ester
SpectraBase Compound ID Kgz5Y4HC8Fp
InChI InChI=1S/C16H20O6S/c1-11-5-7-13(8-6-11)23(19,20)10-12(2)9-14(15(17)21-3)16(18)22-4/h5-8,14H,2,9-10H2,1,3-4H3
InChIKey RRLSYLYIQXXWIH-UHFFFAOYSA-N
Mol Weight 340.39 g/mol
Molecular Formula C16H20O6S
Exact Mass 340.09806 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ANjBstkTcib
Name 2-[2-(tosylmethyl)allyl]malonic acid dimethyl ester
Alternate Name(s) 2-[2-[(4-methylphenyl)sulfonylmethyl]prop-2-enyl]propanedioic acid dimethyl ester Dimethyl 2-[2-(p-tolylsulfonylmethyl)allyl]propanedioate Dimethyl 2-[2-[(4-methylphenyl)sulfonylmethyl]prop-2-enyl]propanedioate
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Formula C16H20O6S
InChI InChI=1S/C16H20O6S/c1-11-5-7-13(8-6-11)23(19,20)10-12(2)9-14(15(17)21-3)16(18)22-4/h5-8,14H,2,9-10H2,1,3-4H3
InChIKey RRLSYLYIQXXWIH-UHFFFAOYSA-N
Molecular Weight 340.390 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)C(CC(C(=O)OC)C(=O)OC)=C
SPLASH splash10-000i-2900000000-d2aab1dbc0b41671ff95
Source of Spectrum F-48-5188-8
Wiley ID 1334931