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1-[3'-{N-(trifluoroacetyl)-N-(t-butyl)amino}-2'-(trifluoroacetoxy)propoxy]-6,7-bis(trifluoroacetoxy)-5,6,7,8-tetrahydronaphthalene

View entire compound with spectra: 1 MS (GC)

1-[3'-{N-(trifluoroacetyl)-N-(t-butyl)amino}-2'-(trifluoroacetoxy)propoxy]-6,7-bis(trifluoroacetoxy)-5,6,7,8-tetrahydronaphthalene
SpectraBase Compound ID 9rqMFNm1e0B
InChI InChI=1S/C25H23F12NO8/c1-21(2,3)38(17(39)22(26,27)28)9-12(44-18(40)23(29,30)31)10-43-14-6-4-5-11-7-15(45-19(41)24(32,33)34)16(8-13(11)14)46-20(42)25(35,36)37/h4-6,12,15-16H,7-10H2,1-3H3
InChIKey QFLSUEJQXUKMNZ-UHFFFAOYSA-N
Mol Weight 693.44 g/mol
Molecular Formula C25H23F12NO8
Exact Mass 693.123205 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EYHl5OMoSHe
Name 1-[3'-{N-(trifluoroacetyl)-N-(t-butyl)amino}-2'-(trifluoroacetoxy)propoxy]-6,7-bis(trifluoroacetoxy)-5,6,7,8-tetrahydronaphthalene
Alternate Name(s) 2-({6,7-bis[(trifluoroacetyl)oxy]-5,6,7,8-tetrahydro-1-naphthalenyl}oxy)-1-{[tert-butyl(trifluoroacetyl)amino]methyl}ethyl trifluoroacetate Tetrakis(trifluoroacetyl)nadolol derivative
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Formula C25H23F12NO8
InChI InChI=1S/C25H23F12NO8/c1-21(2,3)38(17(39)22(26,27)28)9-12(44-18(40)23(29,30)31)10-43-14-6-4-5-11-7-15(45-19(41)24(32,33)34)16(8-13(11)14)46-20(42)25(35,36)37/h4-6,12,15-16H,7-10H2,1-3H3
InChIKey QFLSUEJQXUKMNZ-UHFFFAOYSA-N
Molecular Weight 693.439 g/mol
SMILES C(N(C(C)(C)C)CC(OC(C(F)(F)F)=O)COc1c2CC(OC(C(F)(F)F)=O)C(Cc2ccc1)OC(C(F)(F)F)=O)(C(F)(F)F)=O
SPLASH splash10-066r-6390000000-67681265de4230eee245
Source of Spectrum CJ-0-43-0
Wiley ID 1414813