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7-Hydroxy-4-methyl-3-tridecafluorohexylcoumarin
SpectraBase Compound ID KXcNcILIccc
InChI InChI=1S/C16H7F13O3/c1-5-7-3-2-6(30)4-8(7)32-10(31)9(5)11(17,18)12(19,20)13(21,22)14(23,24)15(25,26)16(27,28)29/h2-4,30H,1H3
InChIKey XHORNQCNILFCQX-UHFFFAOYSA-N
Mol Weight 494.21 g/mol
Molecular Formula C16H7F13O3
Exact Mass 494.01876 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GdBaj9HmBqG
Name 7-Hydroxy-4-methyl-3-tridecafluorohexylcoumarin
Alternate Name(s) 7-Hydroxy-4-methyl-3-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-2H-chromen-2-one
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Formula C16H7F13O3
InChI InChI=1S/C16H7F13O3/c1-5-7-3-2-6(30)4-8(7)32-10(31)9(5)11(17,18)12(19,20)13(21,22)14(23,24)15(25,26)16(27,28)29/h2-4,30H,1H3
InChIKey XHORNQCNILFCQX-UHFFFAOYSA-N
Molecular Weight 494.208 g/mol
SMILES Oc1ccc2c(c1)OC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)=C2C)=O
SPLASH splash10-004j-3090700000-24b021b54ab58dcee39d
Source of Spectrum KC-0-103-3
Wiley ID 780469