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2-Bromo-9,10-dihydroxy-1,8-cineole - bromoacetonide
SpectraBase Compound ID 9osfMNdwcZl
InChI InChI=1S/C13H20Br2O3/c1-11-4-3-9(5-10(11)15)13(18-11)7-16-12(2,6-14)17-8-13/h9-10H,3-8H2,1-2H3/t9-,10+,11+,12?,13?/m0/s1
InChIKey AOFAVKXVHNCZMC-DBSGOBSLSA-N
Mol Weight 384.11 g/mol
Molecular Formula C13H20Br2O3
Exact Mass 381.977921 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gsis3rQ5A40
Name 2-Bromo-9,10-dihydroxy-1,8-cineole - bromoacetonide
Alternate Name(s) 5-Bromo-6'-(bromomethyl)-4,6'-dimethyl-3-oxaspiro[bicyclo[2.2.2]octane-2,3'-[1,5]dioxane]
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Formula C13H20Br2O3
InChI InChI=1S/C13H20Br2O3/c1-11-4-3-9(5-10(11)15)13(18-11)7-16-12(2,6-14)17-8-13/h9-10H,3-8H2,1-2H3/t9-,10+,11+,12?,13?/m0/s1
InChIKey AOFAVKXVHNCZMC-DBSGOBSLSA-N
Molecular Weight 384.108 g/mol
SMILES C12(O[C@]3(C)CC[C@]2(C[C@]3(Br)[H])[H])COC(OC1)(CBr)C
SPLASH splash10-000x-9381000000-b4a621684334497868c5
Source of Spectrum B-54-774-15
Wiley ID 840802