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3-(4-(difluoromethoxy)phenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile
SpectraBase Compound ID 47PqDkjKwj6
InChI InChI=1S/C25H23F2NO2/c1-17(2)24(18-11-13-21(14-12-18)30-25(26)27)23(16-28)19-7-6-10-22(15-19)29-20-8-4-3-5-9-20/h3-15,17,23-25H,1-2H3
InChIKey UIKKHMMIUAYWSP-UHFFFAOYSA-N
Mol Weight 407.46 g/mol
Molecular Formula C25H23F2NO2
Exact Mass 407.169685 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 738JcBcx1iW
Name 3-(4-(difluoromethoxy)phenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H23F2NO2
InChI InChI=1S/C25H23F2NO2/c1-17(2)24(18-11-13-21(14-12-18)30-25(26)27)23(16-28)19-7-6-10-22(15-19)29-20-8-4-3-5-9-20/h3-15,17,23-25H,1-2H3
InChIKey UIKKHMMIUAYWSP-UHFFFAOYSA-N
Molecular Weight 407.461 g/mol
SMILES c1(C(C(C)C)C(c2cccc(c2)Oc2ccccc2)C#N)ccc(cc1)OC(F)F
SPLASH splash10-0002-0900000000-626d992c0e6ef90f3ad5
Source of Spectrum RCM-23-3679-FLU6
Synonyms decarboxy-flucythrinate
Wiley ID 1820653