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2,2-DINITRO-1,3-PROPYLENE-DITRIFLATE

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2,2-DINITRO-1,3-PROPYLENE-DITRIFLATE
SpectraBase Compound ID 6qNpT2HT0Ff
InChI InChI=1S/C5H4F6N2O10S2/c6-4(7,8)24(18,19)22-1-3(12(14)15,13(16)17)2-23-25(20,21)5(9,10)11/h1-2H2
InChIKey SNLUOXGYXOVEJD-UHFFFAOYSA-N
Mol Weight 430.2 g/mol
Molecular Formula C5H4F6N2O10S2
Exact Mass 429.921156 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L5nRRIKye4W
Name 2,2-DINITRO-1,3-PROPYLENE-DITRIFLATE
CAS Registry Number 75233-72-6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H4F6N2O10S2
InChI InChI=1S/C5H4F6N2O10S2/c6-4(7,8)24(18,19)22-1-3(12(14)15,13(16)17)2-23-25(20,21)5(9,10)11/h1-2H2
InChIKey SNLUOXGYXOVEJD-UHFFFAOYSA-N
Literature Reference Author P.T.BERKOWITZ,K.BAUM
Literature Reference Citation J.ORG.CHEM.,45,4853(1980)
Literature Reference DOI 10.1021/jo01312a010
Solvent CDCl3
Source File Reference UWPS1321