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2,2-DINITRO-3-HYDROXY-1-PROPYL-TRIFLATE
SpectraBase Compound ID 85jvvd0sLvf
InChI InChI=1S/C4H5F3N2O8S/c5-4(6,7)18(15,16)17-2-3(1-10,8(11)12)9(13)14/h10H,1-2H2
InChIKey YELKYVKIAFYBSZ-UHFFFAOYSA-N
Mol Weight 298.15 g/mol
Molecular Formula C4H5F3N2O8S
Exact Mass 297.971871 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Pj4ypXnDwP
Name 2,2-DINITRO-3-HYDROXY-1-PROPYL-TRIFLATE
CAS Registry Number 75233-71-5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C4H5F3N2O8S
InChI InChI=1S/C4H5F3N2O8S/c5-4(6,7)18(15,16)17-2-3(1-10,8(11)12)9(13)14/h10H,1-2H2
InChIKey YELKYVKIAFYBSZ-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 UWPS1322