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DIMETHYL_1-ACETYL-4,5,6,7-TETRAHYDROBENZO-[C]-FURAN-TRANS-5,6-DICARBOXYLATE
SpectraBase Compound ID G911doSuMaK
InChI InChI=1S/C14H16O6/c1-7(15)12-9-5-11(14(17)19-3)10(13(16)18-2)4-8(9)6-20-12/h6,10-11H,4-5H2,1-3H3/t10-,11-/m0/s1
InChIKey OAVXKKCNBWXYFC-QWRGUYRKSA-N
Mol Weight 280.28 g/mol
Molecular Formula C14H16O6
Exact Mass 280.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GHcdGhICzUO
Name (5S,6S)-1-acetyl-4,5,6,7-tetrahydroisobenzofuran-5,6-dicarboxylic acid dimethyl ester
Alternate Name(s) Dimethyl (5S,6S)-1-acetyl-4,5,6,7-tetrahydro-2-benzofuran-5,6-dicarboxylate Dimethyl (5S,6S)-1-acetyl-4,5,6,7-tetrahydroisobenzofuran-5,6-dicarboxylate Dimethyl (5S,6S)-1-ethanoyl-4,5,6,7-tetrahydro-2-benzofuran-5,6-dicarboxylate
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Formula C14H16O6
InChI InChI=1S/C14H16O6/c1-7(15)12-9-5-11(14(17)19-3)10(13(16)18-2)4-8(9)6-20-12/h6,10-11H,4-5H2,1-3H3/t10-,11-/m0/s1
InChIKey OAVXKKCNBWXYFC-QWRGUYRKSA-N
Molecular Weight 280.276 g/mol
SMILES c12c(occ2C[C@@]([C@](C1)(C(=O)OC)[H])(C(=O)OC)[H])C(=O)C
SPLASH splash10-006t-0090000000-da3301d8e3bffc4828ab
Source of Spectrum KC-0-2703-11
Wiley ID 786641