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(3aS,8bS)-2,2-dimethyl-5,6,7,8b-tetrahydro-3aH-furo[2,3-b]benzofuran-1,8-dione
SpectraBase Compound ID 33dpPX5RiBb
InChI InChI=1S/C12H14O4/c1-12(2)10(14)9-8-6(13)4-3-5-7(8)15-11(9)16-12/h9,11H,3-5H2,1-2H3/t9-,11+/m1/s1
InChIKey ITJWNDQOKOAXSH-KOLCDFICSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6MA3VxUB3Un
Name (3aS,8bS)-2,2-dimethyl-5,6,7,8b-tetrahydro-3aH-furo[2,3-b]benzofuran-1,8-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-12(2)10(14)9-8-6(13)4-3-5-7(8)15-11(9)16-12/h9,11H,3-5H2,1-2H3/t9-,11+/m1/s1
InChIKey ITJWNDQOKOAXSH-KOLCDFICSA-N
Molecular Weight 222.240 g/mol
SMILES [C@@]12(C3=C(CCCC3=O)O[C@]1(OC(C2=O)(C)C)[H])[H]
SPLASH splash10-00di-0490000000-1f3d6050ee7594523d46
Source of Spectrum C-117-4817-3
Synonyms (3aS,8bS)-2,2-dimethyl-5,6,7,8b-tetrahydro-3aH-furo[2,3-b]benzofuran-1,8-quinone (3aS,8bS)-2,2-dimethyl-5,6,7,8b-tetrahydro-3aH-furo[2,3-b][1]benzofuran-1,8-dione
Wiley ID 758863