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Noradrenaline, N,o,o,o-tetrakis(pentafluorobenzoyl)-

View entire compound with spectra: 1 NMR

Noradrenaline, N,o,o,o-tetrakis(pentafluorobenzoyl)-
SpectraBase Compound ID K5goZT8gvoy
InChI InChI=1S/C36H7F20NO7/c37-13-9(14(38)22(46)29(53)21(13)45)33(58)57-4-8(64-36(61)12-19(43)27(51)32(56)28(52)20(12)44)5-1-2-6(62-34(59)10-15(39)23(47)30(54)24(48)16(10)40)7(3-5)63-35(60)11-17(41)25(49)31(55)26(50)18(11)42/h1-3,8H,4H2,(H,57,58)
InChIKey LMRIGJMWYOZJEW-UHFFFAOYSA-N
Mol Weight 945.4 g/mol
Molecular Formula C36H7F20NO7
Exact Mass 944.990315 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GzY24HmfH1J
Name Noradrenaline, N,o,o,o-tetrakis(pentafluorobenzoyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 944.990314822 u
Formula C36H7F20NO7
InChI InChI=1S/C36H7F20NO7/c37-13-9(14(38)22(46)29(53)21(13)45)33(58)57-4-8(64-36(61)12-19(43)27(51)32(56)28(52)20(12)44)5-1-2-6(62-34(59)10-15(39)23(47)30(54)24(48)16(10)40)7(3-5)63-35(60)11-17(41)25(49)31(55)26(50)18(11)42/h1-3,8H,4H2,(H,57,58)
InChIKey LMRIGJMWYOZJEW-UHFFFAOYSA-N
Molecular Weight 945.420 g/mol
SMILES C1(=C(C(F)=C(C(=C1F)F)F)F)C(NCC(OC(C1=C(C(F)=C(C(=C1F)F)F)F)=O)C1=CC(OC(C2=C(C(F)=C(C(=C2F)F)F)F)=O)=C(OC(C2=C(C(=C(C(=C2F)F)F)F)F)=O)C=C1)=O