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2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluoro-phenyl]-5-propyl-1,2,3,3a,4,5,6,6a-octahydropentalene
SpectraBase Compound ID 9nJ2P5adeRB
InChI InChI=1S/C24H23F7O/c1-2-3-12-4-13-6-15(7-14(13)5-12)16-8-18(25)22(19(26)9-16)24(30,31)32-17-10-20(27)23(29)21(28)11-17/h8-15H,2-7H2,1H3
InChIKey CUMBQWDKYBJQNL-UHFFFAOYSA-N
Mol Weight 460.44 g/mol
Molecular Formula C24H23F7O
Exact Mass 460.163713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 69KDrRH4Na4
Name 2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluoro-phenyl]-5-propyl-1,2,3,3a,4,5,6,6a-octahydropentalene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H23F7O
InChI InChI=1S/C24H23F7O/c1-2-3-12-4-13-6-15(7-14(13)5-12)16-8-18(25)22(19(26)9-16)24(30,31)32-17-10-20(27)23(29)21(28)11-17/h8-15H,2-7H2,1H3
InChIKey CUMBQWDKYBJQNL-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 460.436 g/mol
SMILES c1(cc(cc(c1C(Oc1cc(c(c(c1)F)F)F)(F)F)F)C1CC2C(C1)CC(C2)CCC)F
SPLASH splash10-03di-0009000000-0c91d5610a70c54775f9
Source of Spectrum US20150021520A1
Wiley ID 1850491