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(2S,3S,4aR,8aR)-7-Iodo-2,3-dimethoxy-2,3,6-trimethyl-2,3,4a,5,6,8a-hexahydrobenzo[b][1,4]dioxin-6-ol
SpectraBase Compound ID 7m6njDhiORS
InChI InChI=1S/C13H21IO5/c1-11(15)7-9-8(6-10(11)14)18-12(2,16-4)13(3,17-5)19-9/h6,8-9,15H,7H2,1-5H3/t8-,9-,11?,12+,13+/m1/s1
InChIKey HWKCEKOCWQHZNV-FFBIBOTPSA-N
Mol Weight 384.21 g/mol
Molecular Formula C13H21IO5
Exact Mass 384.043369 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9nFV47jk4sY
Name (2S,3S,4aR,8aR)-7-Iodo-2,3-dimethoxy-2,3,6-trimethyl-2,3,4a,5,6,8a-hexahydrobenzo[b][1,4]dioxin-6-ol
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Formula C13H21IO5
InChI InChI=1S/C13H21IO5/c1-11(15)7-9-8(6-10(11)14)18-12(2,16-4)13(3,17-5)19-9/h6,8-9,15H,7H2,1-5H3/t8-,9-,11?,12+,13+/m1/s1
InChIKey HWKCEKOCWQHZNV-FFBIBOTPSA-N
Molecular Weight 384.210 g/mol
SMILES OC1(C[C@@]2([C@](O[C@]([C@@](O2)(C)OC)(C)OC)(C=C1I)[H])[H])C
SPLASH splash10-052o-9451000000-233f2195523ec2bb3151
Source of Spectrum K1-0-1682-13
Synonyms (2S,3S,4aR,8aR)-7-iodo-2,3-dimethoxy-2,3,6-trimethyl-2,3,4a,5,6,8a-hexahydro-1,4-benzodioxin-6-ol
Wiley ID 1588676