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8-ALPHA-(2'S,3'S-EPOXY-2'-METHYLBUTURYLOXY)-9-BETA-HYDROXYGERMACRA-4E,1(10)-E-DIEN-6-BETA,12-OLIDE
SpectraBase Compound ID kWHLQLMGy1
InChI InChI=1S/C20H26O6/c1-10-7-6-8-11(2)16(21)17(25-19(23)20(5)13(4)26-20)15-12(3)18(22)24-14(15)9-10/h8-9,13-17,21H,3,6-7H2,1-2,4-5H3/b10-9+,11-8+/t13-,14+,15+,16-,17-,20-/m1/s1
InChIKey FPOVYDMKICRBQA-HPYDPVGFSA-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 3tbGjMLM6wT
Name 8.alpha.-((2'R,3'R)-2',3'-Epoxy-2'-methylbutyryloxy)-9.beta.-hydroxyger-macra-4E,1(10)E-dien-6.beta.,12-olide
Appearance gum
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Formula C20H26O6
InChI InChI=1S/C20H26O6/c1-10-7-6-8-11(2)16(21)17(25-19(23)20(5)13(4)26-20)15-12(3)18(22)24-14(15)9-10/h8-9,13-17,21H,3,6-7H2,1-2,4-5H3/b10-9+,11-8+/t13-,14+,15+,16-,17-,20-/m1/s1
InChIKey FPOVYDMKICRBQA-HPYDPVGFSA-N
Instrument Name Finnigan MAT 8200 or Finnigan TSQ 7000 or Agilent 5890 series GC-5973 Network MSD
Ionization Type EI
Literature Reference DOI 10.1021/np034072q
Molecular Weight 362.422 g/mol
Reported Formula C20H26O6
SMILES O[C@@]1(\C(=C\CC\C(=C\[C@]2([C@@]([C@]1(OC([C@]1([C@](O1)(C)[H])C)=O)[H])(C(C(O2)=O)=C)[H])[H])C)C)[H]
SPLASH splash10-0006-9300000000-9c20f2ae5136e8148621
Source of Spectrum G4-67-629-8
Wiley ID 1881771