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3-[(3aR,5R,6S,6aR)-2,2,5-trimethyl-3a,5,6,6a-tetrahydrofuro[4,5-d][1,3]dioxol-6-yl]triazole-4-carboxylic acid ethyl ester
SpectraBase Compound ID HcB0nkfdWU6
InChI InChI=1S/C13H19N3O5/c1-5-18-11(17)8-6-14-15-16(8)9-7(2)19-12-10(9)20-13(3,4)21-12/h6-7,9-10,12H,5H2,1-4H3/t7-,9+,10-,12-/m1/s1
InChIKey FFHMNQUKROMWRM-DLYFRVTGSA-N
Mol Weight 297.31 g/mol
Molecular Formula C13H19N3O5
Exact Mass 297.132471 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6lZ2suzhkbC
Name 3-[(3aR,5R,6S,6aR)-2,2,5-trimethyl-3a,5,6,6a-tetrahydrofuro[4,5-d][1,3]dioxol-6-yl]triazole-4-carboxylic acid ethyl ester
Compound Number 33
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Formula C13H19N3O5
InChI InChI=1S/C13H19N3O5/c1-5-18-11(17)8-6-14-15-16(8)9-7(2)19-12-10(9)20-13(3,4)21-12/h6-7,9-10,12H,5H2,1-4H3/t7-,9+,10-,12-/m1/s1
InChIKey FFHMNQUKROMWRM-DLYFRVTGSA-N
Literature Reference Author J.MARCO-CONTELLES,M.RODRIGUEZ-FERNANDEZ
Literature Reference Citation J.ORG.CHEM.,66,3717(2001)
Literature Reference DOI 10.1021/jo001550i
Molecular Weight 297.311 g/mol
Solvent CDCl3
Source File Reference UWMS27330