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1-[5-fluoranyl-4-(4-methoxyphenyl)-5-methyl-hexyl]-3-phenoxy-benzene
SpectraBase Compound ID 1FZsl0CYLkT
InChI InChI=1S/C26H29FO2/c1-26(2,27)25(21-15-17-22(28-3)18-16-21)14-8-10-20-9-7-13-24(19-20)29-23-11-5-4-6-12-23/h4-7,9,11-13,15-19,25H,8,10,14H2,1-3H3
InChIKey SLUKTWSEKQGKNE-UHFFFAOYSA-N
Mol Weight 392.51 g/mol
Molecular Formula C26H29FO2
Exact Mass 392.215158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KmpgFUqghBI
Name 1-[5-fluoranyl-4-(4-methoxyphenyl)-5-methyl-hexyl]-3-phenoxy-benzene
Alternate Name(s) 1-[5-fluoro-4-(4-methoxyphenyl)-5-methyl-hexyl]-3-phenoxy-benzene
Comments Less than 3 mono-isotopic peaks
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Formula C26H29FO2
InChI InChI=1S/C26H29FO2/c1-26(2,27)25(21-15-17-22(28-3)18-16-21)14-8-10-20-9-7-13-24(19-20)29-23-11-5-4-6-12-23/h4-7,9,11-13,15-19,25H,8,10,14H2,1-3H3
InChIKey SLUKTWSEKQGKNE-UHFFFAOYSA-N
Molecular Weight 392.514 g/mol
SMILES C(CCC(C(C)(C)F)c1ccc(cc1)OC)c1cc(ccc1)Oc1ccccc1
SPLASH splash10-03di-0902000000-870acb4f6752999efb5c
Source of Spectrum AJ-65-2407-24
Wiley ID 771691