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(E)-5-[(3aR,5R,6S,6aR)-6-hydroxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-methyl-2-pentenoic acid ethyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(E)-5-[(3aR,5R,6S,6aR)-6-hydroxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-methyl-2-pentenoic acid ethyl ester
SpectraBase Compound ID DsJbA29sl8F
InChI InChI=1S/C15H24O6/c1-5-18-13(17)9(2)7-6-8-10-11(16)12-14(19-10)21-15(3,4)20-12/h7,10-12,14,16H,5-6,8H2,1-4H3/b9-7+/t10-,11+,12-,14-/m1/s1
InChIKey IXXJREOLGNYNBG-VQMNWHOUSA-N
Mol Weight 300.35 g/mol
Molecular Formula C15H24O6
Exact Mass 300.157288 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LRgypQLGqOY
Name (E)-5-[(3ar,5R,6S,6ar)-6-Hydroxy-2,2-dimethyl-3A,5,6,6A-tetrahydrofuro[2,3-D][1,3]dioxol-5-yl]-2-methyl-2-pentenoic acid ethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 300.157288487 u
Formula C15H24O6
InChI InChI=1S/C15H24O6/c1-5-18-13(17)9(2)7-6-8-10-11(16)12-14(19-10)21-15(3,4)20-12/h7,10-12,14,16H,5-6,8H2,1-4H3/b9-7+/t10-,11+,12-,14-/m1/s1
InChIKey IXXJREOLGNYNBG-VQMNWHOUSA-N
SMILES [C@@]12([C@@](OC(O2)(C)C)(O[C@@]([C@@]1(O)[H])(CC\C=C\(C(=O)OCC)C)[H])[H])[H]