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5,6-Diacetyl-7-dimethoxymethylbicyclo[2.2.1]hept-2-ene
SpectraBase Compound ID D3DBoEZwNUh
InChI InChI=1S/C14H20O4/c1-7(15)11-9-5-6-10(12(11)8(2)16)13(9)14(17-3)18-4/h5-6,9-14H,1-4H3/t9-,10+,11?,12?,13-
InChIKey TUFOSJKZKADVTD-UHFFFAOYSA-N
Mol Weight 252.31 g/mol
Molecular Formula C14H20O4
Exact Mass 252.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LQBVnWqWnDl
Name 5,6-Diacetyl-7-dimethoxymethylbicyclo[2.2.1]hept-2-ene
Comments Less than 3 mono-isotopic peaks
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Formula C14H20O4
InChI InChI=1S/C14H20O4/c1-7(15)11-9-5-6-10(12(11)8(2)16)13(9)14(17-3)18-4/h5-6,9-14H,1-4H3/t9-,10+,11+,12-,13?
InChIKey TUFOSJKZKADVTD-UHFFFAOYSA-N
Molecular Weight 252.310 g/mol
SMILES [C@]12([C@]([C@@](C(=O)C)([C@](C2C(OC)OC)(C=C1)[H])[H])(C(=O)C)[H])[H]
SPLASH splash10-00di-0090000000-abfca37d69710901db75
Source of Spectrum J-64-1581-5
Synonyms 2,3-Bis-endo-diacetyl-7-anti-dimethoxymethylbicyclo[2.2.1]-5-heptene 1-[3-acetyl-7-(dimethoxymethyl)bicyclo[2.2.1]hept-5-en-2-yl]ethanone
Wiley ID 1529513