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7-Acetyl-6-bromo-3,3-dimethoxy5-(1,3-dioxolan-2-yl)bicyclo[2.2.2]oct-5-ene-2-one
SpectraBase Compound ID Ftmz5LTmzd5
InChI InChI=1S/C15H19BrO6/c1-7(17)8-6-9-11(14-21-4-5-22-14)12(16)10(8)13(18)15(9,19-2)20-3/h8-10,14H,4-6H2,1-3H3/t8-,9-,10+/m0/s1
InChIKey HNGUQIPLPCBBOS-LPEHRKFASA-N
Mol Weight 375.22 g/mol
Molecular Formula C15H19BrO6
Exact Mass 374.036501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8GI9pIUpPtY
Name 7-Acetyl-6-bromo-3,3-dimethoxy5-(1,3-dioxolan-2-yl)bicyclo[2.2.2]oct-5-ene-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19BrO6
InChI InChI=1S/C15H19BrO6/c1-7(17)8-6-9-11(14-21-4-5-22-14)12(16)10(8)13(18)15(9,19-2)20-3/h8-10,14H,4-6H2,1-3H3/t8-,9-,10+/m0/s1
InChIKey HNGUQIPLPCBBOS-LPEHRKFASA-N
Molecular Weight 375.215 g/mol
SMILES C1(=C([C@]2([C@@](C[C@@]1(C(C2=O)(OC)OC)[H])(C(=O)C)[H])[H])Br)C1OCCO1
SPLASH splash10-0fl0-9553000000-f45ff5cb25b0a37a8ddc
Source of Spectrum J-67-6500-28
Synonyms (1R*,4S*,7S*)-7-Acetyl-6-bromo-3,3-dimethoxy5-(1,3-dioxolan-2-yl)bicyclo[2.2.2]oct-5-ene-2-one 7-Acetyl-6-bromo-5-(1,3-dioxolan-2-yl)-3,3-dimethoxybicyclo[2.2.2]oct-5-en-2-one
Wiley ID 1570840