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1-[N-(tert-Butoxycarbonyl)-N-propylaminomethyl]-4-[2-(tridecafluorohexyl)ethyl)benzene
SpectraBase Compound ID 3WktvbtzKFW
InChI InChI=1S/C23H26F13NO2/c1-5-15(16(38)39-17(2,3)4)37-12-14-8-6-13(7-9-14)10-11-18(24,25)19(26,27)20(28,29)21(30,31)22(32,33)23(34,35)36/h6-9,15,37H,5,10-12H2,1-4H3
InChIKey GQGRUHNMQLCZTH-UHFFFAOYSA-N
Mol Weight 595.45 g/mol
Molecular Formula C23H26F13NO2
Exact Mass 595.175595 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7lic9U0Dhk3
Name 1-[N-(tert-Butoxycarbonyl)-N-propylaminomethyl]-4-[2-(tridecafluorohexyl)ethyl)benzene
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Formula C23H26F13NO2
InChI InChI=1S/C23H26F13NO2/c1-5-15(16(38)39-17(2,3)4)37-12-14-8-6-13(7-9-14)10-11-18(24,25)19(26,27)20(28,29)21(30,31)22(32,33)23(34,35)36/h6-9,15,37H,5,10-12H2,1-4H3
InChIKey GQGRUHNMQLCZTH-UHFFFAOYSA-N
Molecular Weight 595.445 g/mol
SMILES N(Cc1ccc(CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)cc1)C(C(OC(C)(C)C)=O)CC
SPLASH splash10-000i-1000900000-aceaabe87a6062626f34
Source of Spectrum F-70-3413-6
Synonyms tert-Butyl 2-{[4-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)benzyl]amino}butanoate
Wiley ID 1596803