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8,8-Dimethyl-5-[2-(methoxy)ethenyl]-5-methoxy-3-[(2-iodo-3-methoxy-5-(methoxycarbonyl)phenyl]-3-aza-4,7,9-trioxabicyclo[4.3.0]nonane
SpectraBase Compound ID 9Go68phSERJ
InChI InChI=1S/C20H26INO8/c1-19(2)28-15-11-22(30-20(27-6,7-8-24-3)17(15)29-19)13-9-12(18(23)26-5)10-14(25-4)16(13)21/h7-10,15,17H,11H2,1-6H3/b8-7-/t15-,17-,20+/m0/s1
InChIKey PDBYTDFDSBQWNA-CIUPNIQXSA-N
Mol Weight 535.33 g/mol
Molecular Formula C20H26INO8
Exact Mass 535.070312 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CmpgCZvAxMt
Name 8,8-Dimethyl-5-[2-(methoxy)ethenyl]-5-methoxy-3-[(2-iodo-3-methoxy-5-(methoxycarbonyl)phenyl]-3-aza-4,7,9-trioxabicyclo[4.3.0]nonane
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Formula C20H26INO8
InChI InChI=1S/C20H26INO8/c1-19(2)28-15-11-22(30-20(27-6,7-8-24-3)17(15)29-19)13-9-12(18(23)26-5)10-14(25-4)16(13)21/h7-10,15,17H,11H2,1-6H3/b8-7-/t15-,17-,20+/m0/s1
InChIKey PDBYTDFDSBQWNA-CIUPNIQXSA-N
Molecular Weight 535.331 g/mol
SMILES c1(N2O[C@@](\C=C/OC)(OC)[C@@]3([C@](C2)(OC(C)(C)O3)[H])[H])c(c(OC)cc(c1)C(=O)OC)I
SPLASH splash10-00di-0900000000-c3777ce9e29508152d7d
Source of Spectrum J-59-358-8
Synonyms 4-Iodo-3-methoxy-5-[(3aS,4R,7aS)-4-methoxy-4-((Z)-2-methoxy-vinyl)-2,2-dimethyl-tetrahydro-1,3,5-trioxa-6-aza-inden-6-yl]-benzoic acid methyl ester Methyl 4-iodo-3-methoxy-5-{4-methoxy-4-[(Z)-2-methoxyethenyl]-2,2-dimethyltetrahydro-6H-[1,3]dioxolo[4,5-d][1,2]oxazin-6-yl}benzoate 3-[(3aS,4R,7aS)-4-methoxy-4-[(Z)-2-methoxyethenyl]-2,2-dimethyl-7,7a-dihydro-3aH-[1,3]dioxolo[4,5-d]oxazin-6-yl]-4-iodo-5-methoxybenzoic acid methyl ester Methyl 3-[(3aS,4R,7aS)-4-methoxy-4-[(Z)-2-methoxyethenyl]-2,2-dimethyl-7,7a-dihydro-3aH-[1,3]dioxolo[4,5-d]oxazin-6-yl]-4-iodo-5-methoxybenzoate Methyl 3-[(3aS,4R,7aS)-4-methoxy-4-[(Z)-2-methoxyvinyl]-2,2-dimethyl-7,7a-dihydro-3aH-[1,3]dioxolo[4,5-d]oxazin-6-yl]-4-iodo-5-methoxy-benzoate Methyl 3-[(3aS,4R,7aS)-4-methoxy-4-[(Z)-2-methoxyethenyl]-2,2-dimethyl-7,7a-dihydro-3aH-[1,3]dioxolo[4,5-d][1,2]oxazin-6-yl]-4-iodanyl-5-methoxy-benzoate
Wiley ID 1403923