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Propanoic acid, 2,2-dimethyl-, [2,3,3a,9a-tetrahydro-6-oxo-3-[(trifluoroacetyl)oxy]-6H-furo[2',3':4,5]oxazolo[3,2-a]pyrimidin-2-yl]methyl ester, [2R-(2.alpha.,3.beta.,3a.beta.,9a.beta.)]-
SpectraBase Compound ID fFSaADLuDZ
InChI InChI=1S/C16H17F3N2O7/c1-15(2,3)12(23)25-6-7-9(27-13(24)16(17,18)19)10-11(26-7)21-5-4-8(22)20-14(21)28-10/h4-5,7,9-11H,6H2,1-3H3
InChIKey XHUGLWYIRJVVKW-UHFFFAOYSA-N
Mol Weight 406.31 g/mol
Molecular Formula C16H17F3N2O7
Exact Mass 406.098785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ZQcTDCjol7
Name Propanoic acid, 2,2-dimethyl-, [2,3,3a,9a-tetrahydro-6-oxo-3-[(trifluoroacetyl)oxy]-6H-furo[2',3':4,5]oxazolo[3,2-a]pyrimidin-2-yl]methyl ester, [2R-(2.alpha.,3.beta.,3a.beta.,9a.beta.)]-
CAS Registry Number 40732-71-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17F3N2O7
InChI InChI=1S/C16H17F3N2O7/c1-15(2,3)12(23)25-6-7-9(27-13(24)16(17,18)19)10-11(26-7)21-5-4-8(22)20-14(21)28-10/h4-5,7,9-11H,6H2,1-3H3
InChIKey XHUGLWYIRJVVKW-UHFFFAOYSA-N
Molecular Weight 406.314 g/mol
SMILES CC(C)(C)C(=O)OCC1C(C2C(N3C=CC(N=C3O2)=O)O1)OC(C(F)(F)F)=O
SPLASH splash10-05ox-8912000000-d634bb7f9d3eda574d2e
Source of Spectrum O7-0-317-0
Synonyms (6-Oxo-3-[(trifluoroacetyl)oxy]-2,3,3a,9a-tetrahydro-6H-furo[2',3':4,5][1,3]oxazolo[3,2-a]pyrimidin-2-yl)methyl pivalate 2,2-Dimethylpropanoic acid [6-oxo-3-(2,2,2-trifluoro-1-oxoethoxy)-2,3,3a,9a-tetrahydrofuro[1,2]oxazolo[3,4-a]pyrimidin-2-yl]methyl ester [6-oxo-3-(2,2,2-trifluoroacetyl)oxy-2,3,3a,9a-tetrahydrofuro[1,2][1,3]oxazolo[3,4-a]pyrimidin-2-yl]methyl 2,2-dimethylpropanoate [6-oxo-3-(2,2,2-trifluoroacetyl)oxy-2,3,3a,9a-tetrahydrofuro[1,2]oxazolo[3,4-a]pyrimidin-2-yl]methyl 2,2-dimethylpropanoate [6-oxidanylidene-3-[2,2,2-tris(fluoranyl)ethanoyloxy]-2,3,3a,9a-tetrahydrofuro[1,2][1,3]oxazolo[3,4-a]pyrimidin-2-yl]methyl 2,2-dimethylpropanoate
Wiley ID 1371929