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(3aS*,6aS*) [(E)-[3-(2,5,5-Trimethyl-[1,3]dioxan-2-yl)-(E)-allylidene]-6a-(4-methoxyphenoxy-methyl)-5',5'-dimethyl-3a,6a-dihydrospiro[4H-cyclopenta[b]furan-4,2'-[1.3]dioxan]-2-ol
SpectraBase Compound ID Ac5AMOsZ7au
InChI InChI=1S/C30H40O8/c1-26(2)16-34-28(5,35-17-26)13-7-8-23-24-29(38-25(23)31,20-33-22-11-9-21(32-6)10-12-22)14-15-30(24)36-18-27(3,4)19-37-30/h7-15,24-25,31H,16-20H2,1-6H3/b13-7+,23-8+/t24-,25?,29+/m0/s1
InChIKey SGCGJMNBZOFZOR-HJMKXJSTSA-N
Mol Weight 528.6 g/mol
Molecular Formula C30H40O8
Exact Mass 528.272318 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2WE1rUnASLA
Name (3aS*,6aS*) [(E)-[3-(2,5,5-Trimethyl-[1,3]dioxan-2-yl)-(E)-allylidene]-6a-(4-methoxyphenoxy-methyl)-5',5'-dimethyl-3a,6a-dihydrospiro[4H-cyclopenta[b]furan-4,2'-[1.3]dioxan]-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H40O8
InChI InChI=1S/C30H40O8/c1-26(2)16-34-28(5,35-17-26)13-7-8-23-24-29(38-25(23)31,20-33-22-11-9-21(32-6)10-12-22)14-15-30(24)36-18-27(3,4)19-37-30/h7-15,24-25,31H,16-20H2,1-6H3/b13-7+,23-8+/t24-,25?,29+/m0/s1
InChIKey SGCGJMNBZOFZOR-HJMKXJSTSA-N
Literature Reference DOI 10.1002_(SICI)1521-3897(199905)341_4_384
Molecular Weight 528.642 g/mol
SMILES OC1\C(=C\C=C\C2(OCC(C)(C)CO2)C)[C@@]2(C3(C=C[C@]2(COc2ccc(cc2)OC)O1)OCC(CO3)(C)C)[H]
SPLASH splash10-004i-3901000000-e5ba7dc923dedae73e82
Source of Spectrum JF-341-389-16
Synonyms (3aS,6aS,E)-6a-((4-methoxyphenoxy)methyl)-5',5'-dimethyl-3-((E)-3-(2,5,5-trimethyl-1,3-dioxan-2-yl)allylidene)-2,3,3a,6a-tetrahydrospiro[cyclopenta[b]furan-4,2'-[1,3]dioxan]-2-ol
Wiley ID 1766723