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[2R-[2.alpha.(E),3.beta.(Z,E)]]-3-methyl-5-oxo-1-[tetrahydro-2-(3-hydroxy-2-methyl-1-propenyl)-4-methylene-5-oxo-3-furanyl]-3-pentenyl ester of 2-methyl-2-butenoic acid
SpectraBase Compound ID 1CcAdOXBqZ5
InChI InChI=1S/C20H26O6/c1-6-14(4)19(23)25-16(9-12(2)7-8-21)18-15(5)20(24)26-17(18)10-13(3)11-22/h6-8,10,16-18,22H,5,9,11H2,1-4H3/b12-7+,13-10+,14-6+/t16?,17-,18-/m1/s1
InChIKey XJQCPAWZNYZPSD-KBZNRERWSA-N
Mol Weight 362.42 g/mol
Molecular Formula C20H26O6
Exact Mass 362.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9y3TgbjpXSj
Name [2R-[2.alpha.(E),3.beta.(Z,E)]]-3-methyl-5-oxo-1-[tetrahydro-2-(3-hydroxy-2-methyl-1-propenyl)-4-methylene-5-oxo-3-furanyl]-3-pentenyl ester of 2-methyl-2-butenoic acid
CAS Registry Number 55051-66-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26O6
InChI InChI=1S/C20H26O6/c1-6-14(4)19(23)25-16(9-12(2)7-8-21)18-15(5)20(24)26-17(18)10-13(3)11-22/h6-8,10,16-18,22H,5,9,11H2,1-4H3/b12-7+,13-10+,14-6+/t16?,17-,18-/m1/s1
InChIKey XJQCPAWZNYZPSD-KBZNRERWSA-N
Molecular Weight 362.422 g/mol
SMILES OC\C(=C\[C@]1(OC(C([C@@]1(C(OC(\C(=C\C)C)=O)C\C(=C\C=O)C)[H])=C)=O)[H])C
SPLASH splash10-001i-9300000000-e8c7c8e2546b2fffa992
Source of Spectrum J-41-1252-0
Synonyms (1R,3E)-1-{(2R,3R)-2-[(1E)-3-hydroxy-2-methyl-1-propenyl]-4-methylene-5-oxotetrahydro-3-furanyl}-3-methyl-5-oxo-3-pentenyl (2E)-2-methyl-2-butenoate
Wiley ID 1349599