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3-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluoro-phenyl]-9-propyl-2-oxaspiro[5.5]undecane
SpectraBase Compound ID 4rCubX6JLzJ
InChI InChI=1S/C26H27F7O2/c1-2-3-15-4-7-25(8-5-15)9-6-22(34-14-25)16-10-18(27)23(19(28)11-16)26(32,33)35-17-12-20(29)24(31)21(30)13-17/h10-13,15,22H,2-9,14H2,1H3
InChIKey QPAWNQHDFSQUOZ-UHFFFAOYSA-N
Mol Weight 504.49 g/mol
Molecular Formula C26H27F7O2
Exact Mass 504.189927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FwehJvyxSoo
Name 3-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluoro-phenyl]-9-propyl-2-oxaspiro[5.5]undecane
Appearance Crystalline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H27F7O2
InChI InChI=1S/C26H27F7O2/c1-2-3-15-4-7-25(8-5-15)9-6-22(34-14-25)16-10-18(27)23(19(28)11-16)26(32,33)35-17-12-20(29)24(31)21(30)13-17/h10-13,15,22H,2-9,14H2,1H3
InChIKey QPAWNQHDFSQUOZ-UHFFFAOYSA-N
Instrument Name Shimadzu QP2010SE
Ionization Type EI
Molecular Weight 504.489 g/mol
SMILES C12(CCC(CC2)CCC)COC(c2cc(c(c(c2)F)C(Oc2cc(c(c(c2)F)F)F)(F)F)F)CC1
SPLASH splash10-0a4i-0009000000-2a0ec6373c7291c0d490
Source of Spectrum CN106520140A
Wiley ID 1855183