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7-Methoxy dipt, N-heptafluorobutyryl-

View entire compound with spectra: 1 NMR

7-Methoxy dipt, N-heptafluorobutyryl-
SpectraBase Compound ID 75P9J4p6wZA
InChI InChI=1S/C21H25F7N2O2/c1-12(2)29(13(3)4)10-9-14-11-30(17-15(14)7-6-8-16(17)32-5)18(31)19(22,23)20(24,25)21(26,27)28/h6-8,11-13H,9-10H2,1-5H3
InChIKey HXBFHTKDCMHWQH-UHFFFAOYSA-N
Mol Weight 470.43 g/mol
Molecular Formula C21H25F7N2O2
Exact Mass 470.180425 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7p4HB6ncjlS
Name 7-Methoxy dipt, N-heptafluorobutyryl-
Comments Computed using HOSE algorithm
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Exact Mass 470.180425192 u
Formula C21H25F7N2O2
InChI InChI=1S/C21H25F7N2O2/c1-12(2)29(13(3)4)10-9-14-11-30(17-15(14)7-6-8-16(17)32-5)18(31)19(22,23)20(24,25)21(26,27)28/h6-8,11-13H,9-10H2,1-5H3
InChIKey HXBFHTKDCMHWQH-UHFFFAOYSA-N
Molecular Weight 470.432 g/mol
SMILES C12=C(C(=CC=C2)OC)N(C(=O)C(C(C(F)(F)F)(F)F)(F)F)C=C1CCN(C(C)C)C(C)C