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2,3-(Isopropylidenedioxy)-5-(2',2'-dimethyl-1',3'-dioxalan-4'-yl)tetrahydrofuran-4-yl (R)-bicyclo[2.2.1]hept-5-en-2-carboxylate

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2,3-(Isopropylidenedioxy)-5-(2',2'-dimethyl-1',3'-dioxalan-4'-yl)tetrahydrofuran-4-yl (R)-bicyclo[2.2.1]hept-5-en-2-carboxylate
SpectraBase Compound ID IKhfXTMCQap
InChI InChI=1S/C20H28O7/c1-19(2)22-9-13(25-19)14-15(16-18(24-14)27-20(3,4)26-16)23-17(21)12-8-10-5-6-11(12)7-10/h5-6,10-16,18H,7-9H2,1-4H3/t10-,11+,12-,13?,14?,15?,16?,18?/m1/s1
InChIKey OXDBVOKCBMYKFK-KFPQTNNNSA-N
Mol Weight 380.44 g/mol
Molecular Formula C20H28O7
Exact Mass 380.183503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3KwKXkfj69l
Name 2,3-(Isopropylidenedioxy)-5-(2',2'-dimethyl-1',3'-dioxalan-4'-yl)tetrahydrofuran-4-yl (R)-bicyclo[2.2.1]hept-5-en-2-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 380.183503235 u
Formula C20H28O7
InChI InChI=1S/C20H28O7/c1-19(2)22-9-13(25-19)14-15(16-18(24-14)27-20(3,4)26-16)23-17(21)12-8-10-5-6-11(12)7-10/h5-6,10-16,18H,7-9H2,1-4H3/t10-,11+,12-,13?,14?,15?,16?,18?/m1/s1
InChIKey OXDBVOKCBMYKFK-KFPQTNNNSA-N
Molecular Weight 380.437 g/mol
SMILES C12C(C(C3OC(C)(C)OC3)OC1OC(O2)(C)C)OC([C@]1([C@]2(C=C[C@@](C1)(C2)[H])[H])[H])=O