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N1,N8-BIS-(TRIFLUOROACETYL)-SPERMIDINE-TRIFLUOROACETATE
SpectraBase Compound ID 6RPCECQQoXm
InChI InChI=1S/C11H17F6N3O2.C2HF3O2/c12-10(13,14)8(21)19-6-2-1-4-18-5-3-7-20-9(22)11(15,16)17;3-2(4,5)1(6)7/h18H,1-7H2,(H,19,21)(H,20,22);(H,6,7)
InChIKey QWYVTEFNXZZDQI-UHFFFAOYSA-N
Mol Weight 451.29 g/mol
Molecular Formula C13H18F9N3O4
Exact Mass 451.11536 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J2ziafFAZJk
Name N1,N8-BIS-(TRIFLUOROACETYL)-SPERMIDINE-TRIFLUOROACETATE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18F9N3O4
InChI InChI=1S/C11H17F6N3O2.C2HF3O2/c12-10(13,14)8(21)19-6-2-1-4-18-5-3-7-20-9(22)11(15,16)17;3-2(4,5)1(6)7/h18H,1-7H2,(H,19,21)(H,20,22);(H,6,7)
InChIKey QWYVTEFNXZZDQI-UHFFFAOYSA-N
Literature Reference Author B.T.GOLDING,A.MITCHINSON,W.CLEGG,M.R.J.ELSEGOOD,R.J.GRIFFIN
Literature Reference Citation J.CHEM.SOC.PERKIN-1,349(1999)
Literature Reference DOI 10.1039/a806355i
Molecular Weight 451.289 g/mol
Solvent DMSO-D6
Source File Reference UWKP2021