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(3a'R,4'S,6a'R)-(4'S)-2'-Bromo-6'-(4-hydroxybutyl)hexahydro-2'H-spiro[1,3-dioxolane-2,1'-pentalen]-4'-ol
SpectraBase Compound ID 4Z7mscfFAtO
InChI InChI=1S/C14H23BrO4/c15-12-8-10-11(17)7-9(3-1-2-4-16)13(10)14(12)18-5-6-19-14/h9-13,16-17H,1-8H2/t9?,10-,11-,12?,13+/m0/s1
InChIKey UHPSTLNCWVYTSK-XNYRDIBGSA-N
Mol Weight 335.24 g/mol
Molecular Formula C14H23BrO4
Exact Mass 334.077972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JhonHqfomHy
Name (3a'R,4'S,6a'R)-(4'S)-2'-Bromo-6'-(4-hydroxybutyl)hexahydro-2'H-spiro[1,3-dioxolane-2,1'-pentalen]-4'-ol
Alternate Name(s) (4'S)-2'-Bromo-6'-(4-hydroxybutyl)hexahydro-2'H-spiro[1,3-dioxolane-2,1'-pentalen]-4'-ol (3a'R,4'S,6a'R)-2'-bromo-6'-(4-hydroxybutyl)hexahydro-2'H-spiro[[1,3]dioxolane-2,1'-pentalen]-4'-ol
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Formula C14H23BrO4
InChI InChI=1S/C14H23BrO4/c15-12-8-10-11(17)7-9(3-1-2-4-16)13(10)14(12)18-5-6-19-14/h9-13,16-17H,1-8H2/t9?,10-,11-,12?,13+/m0/s1
InChIKey UHPSTLNCWVYTSK-XNYRDIBGSA-N
Molecular Weight 335.238 g/mol
SMILES O[C@@]1([C@@]2(CC(C3([C@@]2(C(CCCCO)C1)[H])OCCO3)Br)[H])[H]
SPLASH splash10-0002-9312000000-7e5bfc8b61c6515577b5
Source of Spectrum F-69-7378-22a
Wiley ID 1738304