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Trifluoroethyl-di(pentafluoropropionyl) m-hydroxymandelate
SpectraBase Compound ID 1Kp06xR7Dhd
InChI InChI=1S/C16H7F13O6/c17-12(18,19)5-33-9(30)8(35-11(32)14(22,23)16(27,28)29)6-2-1-3-7(4-6)34-10(31)13(20,21)15(24,25)26/h1-4,8H,5H2
InChIKey STUJNGDCQAACJO-UHFFFAOYSA-N
Mol Weight 542.21 g/mol
Molecular Formula C16H7F13O6
Exact Mass 542.003504 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWbQ75CE5By
Name Trifluoroethyl-di(pentafluoropropionyl) m-hydroxymandelate
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Formula C16H7F13O6
InChI InChI=1S/C16H7F13O6/c17-12(18,19)5-33-9(30)8(35-11(32)14(22,23)16(27,28)29)6-2-1-3-7(4-6)34-10(31)13(20,21)15(24,25)26/h1-4,8H,5H2
InChIKey STUJNGDCQAACJO-UHFFFAOYSA-N
Molecular Weight 542.205 g/mol
SMILES C(C(OC(C(OCC(F)(F)F)=O)c1cc(OC(C(C(F)(F)F)(F)F)=O)ccc1)=O)(C(F)(F)F)(F)F
SPLASH splash10-014i-0900100000-636fa62429215aadf721
Source of Spectrum KO-14-203-5
Synonyms 2-Oxo-1-{3-[(2,2,3,3,3-pentafluoropropanoyl)oxy]phenyl}-2-(2,2,2-trifluoroethoxy)ethyl 2,2,3,3,3-pentafluoropropanoate Trifluoroethyl-di(pentafluoropropionyl) .alpha.-hydroxy-(m-hydroxyphenyl)acetate
Wiley ID 1404772