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4-(1,1,2,2,3,3,3-heptafluoropropyl)-6-methyl-benzene-1,3-dicarboxylic acid dimethyl ester
SpectraBase Compound ID FGV4cWsCbYF
InChI InChI=1S/C14H11F7O4/c1-6-4-9(12(15,16)13(17,18)14(19,20)21)8(11(23)25-3)5-7(6)10(22)24-2/h4-5H,1-3H3
InChIKey PTPBRIUPAFZKCO-UHFFFAOYSA-N
Mol Weight 376.23 g/mol
Molecular Formula C14H11F7O4
Exact Mass 376.054556 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 93Hs8dpQ5iP
Name 4-(1,1,2,2,3,3,3-heptafluoropropyl)-6-methyl-benzene-1,3-dicarboxylic acid dimethyl ester
Alternate Name(s) Dimethyl 4-(1,1,2,2,3,3,3-heptafluoropropyl)-6-methyl-benzene-1,3-dicarboxylate Dimethyl 4-[1,1,2,2,3,3,3-heptakis(fluoranyl)propyl]-6-methyl-benzene-1,3-dicarboxylate 4-(1,1,2,2,3,3,3-heptafluoropropyl)-6-methylbenzene-1,3-dicarboxylic acid dimethyl ester
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Formula C14H11F7O4
InChI InChI=1S/C14H11F7O4/c1-6-4-9(12(15,16)13(17,18)14(19,20)21)8(11(23)25-3)5-7(6)10(22)24-2/h4-5H,1-3H3
InChIKey PTPBRIUPAFZKCO-UHFFFAOYSA-N
Molecular Weight 376.227 g/mol
SMILES C(c1cc(C(=O)OC)c(cc1C)C(C(C(F)(F)F)(F)F)(F)F)(=O)OC
SPLASH splash10-0002-0009000000-5660280935645c7e07f4
Source of Spectrum KC-1993-858-7
Wiley ID 779354