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1-[N-(tert-Butoxycarbonyl)-N-propylaminomethyl]-4-[2-(heptadecafluorooctyl)ethyl)benzene
SpectraBase Compound ID CAil5pZFzte
InChI InChI=1S/C25H26F17NO2/c1-5-15(16(44)45-17(2,3)4)43-12-14-8-6-13(7-9-14)10-11-18(26,27)19(28,29)20(30,31)21(32,33)22(34,35)23(36,37)24(38,39)25(40,41)42/h6-9,15,43H,5,10-12H2,1-4H3
InChIKey PLZHMDBMWGZZIF-UHFFFAOYSA-N
Mol Weight 695.46 g/mol
Molecular Formula C25H26F17NO2
Exact Mass 695.169208 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XVFtqgoEQt
Name 1-[N-(tert-Butoxycarbonyl)-N-propylaminomethyl]-4-[2-(heptadecafluorooctyl)ethyl)benzene
Alternate Name(s) tert-Butyl 2-{[4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)benzyl]amino}butanoate
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Formula C25H26F17NO2
InChI InChI=1S/C25H26F17NO2/c1-5-15(16(44)45-17(2,3)4)43-12-14-8-6-13(7-9-14)10-11-18(26,27)19(28,29)20(30,31)21(32,33)22(34,35)23(36,37)24(38,39)25(40,41)42/h6-9,15,43H,5,10-12H2,1-4H3
InChIKey PLZHMDBMWGZZIF-UHFFFAOYSA-N
Molecular Weight 695.461 g/mol
SMILES N(Cc1ccc(CCC(C(C(C(C(C(C(C(F)(F)F)(F)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-0000090000-d62c846572513d2ccee5
Source of Spectrum F-70-3413-6
Wiley ID 1596802