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Pentafluoropropionyl-2,2,3,3,3-pentafluoropropyl ester derivative of 5-hydroxyindole-3-acetic acid
SpectraBase Compound ID 3Q136Pfix0e
InChI InChI=1S/C19H8F15NO5/c20-14(21,17(26,27)28)6-39-11(36)3-7-5-35(12(37)15(22,23)18(29,30)31)10-2-1-8(4-9(7)10)40-13(38)16(24,25)19(32,33)34/h1-2,4-5H,3,6H2
InChIKey DWFLAIZYPOBWLV-UHFFFAOYSA-N
Mol Weight 615.25 g/mol
Molecular Formula C19H8F15NO5
Exact Mass 615.016295 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID eJDg5yv5iy
Name Pentafluoropropionyl-2,2,3,3,3-pentafluoropropyl ester derivative of 5-hydroxyindole-3-acetic acid
Alternate Name(s) 2,2,3,3,3-Pentafluoro-propionic acid 1-(2,2,3,3,3-pentafluoro-propionyl)-3-(2,2,3,3,3-pentafluoro-propoxycarbonylmethyl)-1H-indol-5-yl ester 2,2,3,3,3-Pentafluoropropyl 5-hydroxyindole-3-acetate-1,5-bis(penta fluoropropionyl) derivative Pentafluoropropionyl-2,2,3,3,3-Pentafluoropropyl ester derivative of 5HIAA
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Formula C19H8F15NO5
InChI InChI=1S/C19H8F15NO5/c20-14(21,17(26,27)28)6-39-11(36)3-7-5-35(12(37)15(22,23)18(29,30)31)10-2-1-8(4-9(7)10)40-13(38)16(24,25)19(32,33)34/h1-2,4-5H,3,6H2
InChIKey DWFLAIZYPOBWLV-UHFFFAOYSA-N
Molecular Weight 615.251 g/mol
SMILES C([n]1cc(CC(OCC(C(F)(F)F)(F)F)=O)c2c1ccc(OC(C(C(F)(F)F)(F)F)=O)c2)(C(C(F)(F)F)(F)F)=O
SPLASH splash10-014i-0000209000-d81a27b43a051e7ad5c5
Source of Spectrum W-0-1046-33
Wiley ID 754194