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Benzene, 1-[1,1-diethyl-2-(4-nitrophenyl)-2-[4-(trifluoromethyl)phenyl]propyl]-4-fluoro-
SpectraBase Compound ID 3amUuNRuHy8
InChI InChI=1S/C26H25F4NO2/c1-4-25(5-2,20-10-14-22(27)15-11-20)24(3,19-12-16-23(17-13-19)31(32)33)18-6-8-21(9-7-18)26(28,29)30/h6-17H,4-5H2,1-3H3
InChIKey GDIHJRGVEQIMPU-UHFFFAOYSA-N
Mol Weight 459.48 g/mol
Molecular Formula C26H25F4NO2
Exact Mass 459.182142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ko5cQT75lG5
Name Benzene, 1-[1,1-diethyl-2-(4-nitrophenyl)-2-[4-(trifluoromethyl)phenyl]propyl]-4-fluoro-
Alternate Name(s) 1-{2-ethyl-2-(4-fluorophenyl)-1-methyl-1-[4-(trifluoromethyl)phenyl]butyl}-4-nitrobenzene 2-[4'-(trifluoromethyl)phenyl]-2-(4''-nitrophenyl)-3-ethyl-3-(4'''-fluorophenyl)pentane
CAS Registry Number 128270-98-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H25F4NO2
InChI InChI=1S/C26H25F4NO2/c1-4-25(5-2,20-10-14-22(27)15-11-20)24(3,19-12-16-23(17-13-19)31(32)33)18-6-8-21(9-7-18)26(28,29)30/h6-17H,4-5H2,1-3H3
InChIKey GDIHJRGVEQIMPU-UHFFFAOYSA-N
Molecular Weight 459.485 g/mol
SMILES c1(N(=O)=O)ccc(C(C(c2ccc(cc2)F)(CC)CC)(c2ccc(C(F)(F)F)cc2)C)cc1
SPLASH splash10-0kai-1921200000-c36c779a28e69dcf4d7d
Source of Spectrum J-55-4558-3
Wiley ID 1390241