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13-(3-Furyl)-1-(2-oxo-3-methyl-4-methoxyfuran-5-ylidene)-4-hydroxy-2,6,10-trimethyltrideca-5,7,9,triene
SpectraBase Compound ID EOdbsXHkQlw
InChI InChI=1S/C26H34O5/c1-18(9-7-11-22-12-13-30-17-22)8-6-10-19(2)14-23(27)15-20(3)16-24-25(29-5)21(4)26(28)31-24/h6,8,10,12-14,16-17,20,23,27H,7,9,11,15H2,1-5H3/b10-6+,18-8+,19-14+,24-16-/t20?,23-/m1/s1
InChIKey OJPKPVSJKGLEOG-FDTRYXPESA-N
Mol Weight 426.6 g/mol
Molecular Formula C26H34O5
Exact Mass 426.240624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ACLmsYnZB2
Name 13-(3-Furyl)-1-(2-oxo-3-methyl-4-methoxyfuran-5-ylidene)-4-hydroxy-2,6,10-trimethyltrideca-5,7,9,triene
Comments Removed - unrepairable contamination (DOP)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H34O5
InChI InChI=1S/C26H34O5/c1-18(9-7-11-22-12-13-30-17-22)8-6-10-19(2)14-23(27)15-20(3)16-24-25(29-5)21(4)26(28)31-24/h6,8,10,12-14,16-17,20,23,27H,7,9,11,15H2,1-5H3/b10-6+,18-8+,19-14+,24-16-/t20?,23-/m1/s1
InChIKey OJPKPVSJKGLEOG-FDTRYXPESA-N
Molecular Weight 426.553 g/mol
SMILES O[C@](\C=C\(\C=C\C=C\(CCCc1cocc1)C)C)(CC(\C=C\1C(=C(C(O1)=O)C)OC)C)[H]
SPLASH splash10-016s-0910000000-0bffdea9c20eb6a1dd11
Source of Spectrum J-62-1699-7
Synonyms (5Z)-5-[(5E,7E,9E)-13-(3-furyl)-4-hydroxy-2,6,10-trimethyl-5,7,9-tridecatrienylidene]-4-methoxy-3-methyl-2(5H)-furanone (S)-13-(3-Furyl)-1-(2-oxo-3-methyl-4-methoxyfuran-5-ylidene)-4-hydroxy-2,6,10-trimethyltrideca-5,7,9,triene
Wiley ID 1380048