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Pentafluoropropionyl-2,2,3,3,3-pentafluoropropyl ester derivative of (2H2)5-hydroxyindole-3-acetic acid
SpectraBase Compound ID 61mJaFk4WKw
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/i3D2
InChIKey DWFLAIZYPOBWLV-SMZGMGDZSA-N
Mol Weight 617.26 g/mol
Molecular Formula C19H62D2F15NO5
Exact Mass 617.028848 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 78TqqOt6SiN
Name Pentafluoropropionyl-2,2,3,3,3-pentafluoropropyl ester derivative of (2H2)5-hydroxyindole-3-acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H6D2F15NO5
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/i3D2
InChIKey DWFLAIZYPOBWLV-SMZGMGDZSA-N
Molecular Weight 617.263 g/mol
SMILES C([n]1cc(C(C(OCC(C(F)(F)F)(F)F)=O)([2D])[2D])c2c1ccc(OC(C(C(F)(F)F)(F)F)=O)c2)(C(C(F)(F)F)(F)F)=O
SPLASH splash10-014i-0000309000-5dd0f77b7c492861f66f
Source of Spectrum W-0-1046-33
Synonyms 2,2,3,3,3-Pentafluoropropyl 5-hydroxyindole-3-dideuterioacetate-1,5-bis(penta fluoropropionyl) derivative Pentafluoropropionyl 2,2,3,3,3-Pentafluoropropyl ester derivative of (dideuterio)-5HIAA
Wiley ID 754193