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2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluoro-5-[4-(2,2,3,3,3-pentadeuteriopropyl)phenyl]benzene
SpectraBase Compound ID FB39kqS9yrA
InChI InChI=1S/C22H15F7O/c1-2-3-12-4-6-13(7-5-12)14-8-16(23)20(17(24)9-14)22(28,29)30-15-10-18(25)21(27)19(26)11-15/h4-11H,2-3H2,1H3/i1D3,2D2
InChIKey YJUHXJQZJUQYJJ-ZBJDZAJPSA-N
Mol Weight 433.38 g/mol
Molecular Formula C22H10D5F7O
Exact Mass 433.132496 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IrCI1XeowmR
Name 2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluoro-5-[4-(2,2,3,3,3-pentadeuteriopropyl)phenyl]benzene
Appearance White crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H10D5F7O
InChI InChI=1S/C22H15F7O/c1-2-3-12-4-6-13(7-5-12)14-8-16(23)20(17(24)9-14)22(28,29)30-15-10-18(25)21(27)19(26)11-15/h4-11H,2-3H2,1H3/i1D3,2D2
InChIKey YJUHXJQZJUQYJJ-ZBJDZAJPSA-N
Ionization Type EI
Molecular Weight 433.380 g/mol
SMILES c1(F)c(F)cc(OC(c2c(F)cc(-c3ccc(CC([D])([D])C([D])([D])[D])cc3)cc2F)(F)F)cc1F
SPLASH splash10-000i-2090000000-9777ef99eac53831721f
Source of Spectrum CN103724168A
Wiley ID 1849644