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(2E,4E,4'R)Ethyl-5-(2',2'-dimethyl- 1',3'dioxolan-4'-yl)-penta-2,4-dienoate

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(2E,4E,4'R)Ethyl-5-(2',2'-dimethyl- 1',3'dioxolan-4'-yl)-penta-2,4-dienoate
SpectraBase Compound ID 7J1zvCv1dmh
InChI InChI=1S/C12H18O4/c1-4-14-11(13)8-6-5-7-10-9-15-12(2,3)16-10/h5-8,10H,4,9H2,1-3H3/b7-5+,8-6+/t10-/m1/s1
InChIKey MHNPWFMTNMMKEH-DETQVXBVSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 59GSNFItZUf
Name (2E,4E,4'R)Ethyl-5-(2',2'-dimethyl- 1',3'dioxolan-4'-yl)-penta-2,4-dienoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 226.120509056 u
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-4-14-11(13)8-6-5-7-10-9-15-12(2,3)16-10/h5-8,10H,4,9H2,1-3H3/b7-5+,8-6+/t10-/m1/s1
InChIKey MHNPWFMTNMMKEH-DETQVXBVSA-N
Molecular Weight 226.272 g/mol
SMILES C(\C=C\C=C\[C@]1(OC(OC1)(C)C)[H])(=O)OCC