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2-Allyl-2-(2-iodobenzyl)malonic acid diethyl ester
SpectraBase Compound ID 6T9Fp6T2b9N
InChI InChI=1S/C17H21IO4/c1-4-11-17(15(19)21-5-2,16(20)22-6-3)12-13-9-7-8-10-14(13)18/h4,7-10H,1,5-6,11-12H2,2-3H3
InChIKey GVPYYQBMUUSKMX-UHFFFAOYSA-N
Mol Weight 416.26 g/mol
Molecular Formula C17H21IO4
Exact Mass 416.048454 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KyT6i3MdaxF
Name 2-Allyl-2-(2-iodobenzyl)malonic acid diethyl ester
Alternate Name(s) 2-[(2-iodophenyl)methyl]-2-prop-2-enylpropanedioic acid diethyl ester Diethyl 2-allyl-2-[(2-iodophenyl)methyl]propanedioate Diethyl 2-[(2-iodanylphenyl)methyl]-2-prop-2-enyl-propanedioate Diethyl 2-[(2-iodophenyl)methyl]-2-prop-2-enylpropanedioate
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Formula C17H21IO4
InChI InChI=1S/C17H21IO4/c1-4-11-17(15(19)21-5-2,16(20)22-6-3)12-13-9-7-8-10-14(13)18/h4,7-10H,1,5-6,11-12H2,2-3H3
InChIKey GVPYYQBMUUSKMX-UHFFFAOYSA-N
Molecular Weight 416.255 g/mol
SMILES C(Cc1c(I)cccc1)(C(=O)OCC)(C(=O)OCC)CC=C
SPLASH splash10-002b-0900000000-dcb28b34d716faeb5f87
Source of Spectrum KC-0-1088-23
Wiley ID 785486