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2-[1-[4-(trifluoromethyl)phenyl]allyl]malonic acid dimethyl ester
SpectraBase Compound ID 9aPTc0cSiLb
InChI InChI=1S/C15H15F3O4/c1-4-11(12(13(19)21-2)14(20)22-3)9-5-7-10(8-6-9)15(16,17)18/h4-8,11-12H,1H2,2-3H3
InChIKey LBZFWDSDFOAYKZ-UHFFFAOYSA-N
Mol Weight 316.28 g/mol
Molecular Formula C15H15F3O4
Exact Mass 316.092243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EdB6EUJkCbK
Name 2-[1-[4-(trifluoromethyl)phenyl]allyl]malonic acid dimethyl ester
Alternate Name(s) 2-[1-[4-(trifluoromethyl)phenyl]prop-2-enyl]propanedioic acid dimethyl ester Dimethyl 2-[1-[4-(trifluoromethyl)phenyl]allyl]propanedioate Dimethyl 2-[1-[4-(trifluoromethyl)phenyl]prop-2-enyl]propanedioate
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Formula C15H15F3O4
InChI InChI=1S/C15H15F3O4/c1-4-11(12(13(19)21-2)14(20)22-3)9-5-7-10(8-6-9)15(16,17)18/h4-8,11-12H,1H2,2-3H3
InChIKey LBZFWDSDFOAYKZ-UHFFFAOYSA-N
Molecular Weight 316.276 g/mol
SMILES C(C(=O)OC)(C(=O)OC)C(c1ccc(C(F)(F)F)cc1)C=C
SPLASH splash10-0a4i-2890000000-fc80bedf4bf2234ce4c2
Source of Spectrum F-51-8872-8
Wiley ID 792848