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Methyl (E)-4,4-[(2S,3S)-1,4-bis(benzoxy)-2,3-butylenedioxy]-2-pentenoate
SpectraBase Compound ID H4zANjjxsGX
InChI InChI=1S/C24H28O6/c1-24(14-13-23(25)26-2)29-21(17-27-15-19-9-5-3-6-10-19)22(30-24)18-28-16-20-11-7-4-8-12-20/h3-14,21-22H,15-18H2,1-2H3/b14-13+/t21-,22-/m0/s1
InChIKey TVWSMGBIRIWHES-WQICJITCSA-N
Mol Weight 412.48 g/mol
Molecular Formula C24H28O6
Exact Mass 412.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1hjrYTuBBYh
Name Methyl (E)-4,4-[(2S,3S)-1,4-bis(benzoxy)-2,3-butylenedioxy]-2-pentenoate
Alternate Name(s) Methyl (2E)-3-{(4S,5S)-4,5-bis[(benzyloxy)methyl]-2-methyl-1,3-dioxolan-2-yl}-2-propenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H28O6
InChI InChI=1S/C24H28O6/c1-24(14-13-23(25)26-2)29-21(17-27-15-19-9-5-3-6-10-19)22(30-24)18-28-16-20-11-7-4-8-12-20/h3-14,21-22H,15-18H2,1-2H3/b14-13+/t21-,22-/m0/s1
InChIKey TVWSMGBIRIWHES-WQICJITCSA-N
Molecular Weight 412.482 g/mol
SMILES C1(O[C@@](COCc2ccccc2)([C@@](O1)(COCc1ccccc1)[H])[H])(\C=C\C(=O)OC)C
SPLASH splash10-0006-9000000000-38829cd30f35d227b345
Source of Spectrum KD-12-1752-9
Wiley ID 1634534