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6,8a-Etheno-8aH-cyclohepta[b]furan-3-carboxylic acid, 2,6-dihydro-2-oxo-, methyl ester
SpectraBase Compound ID EClQlEpBDA2
InChI InChI=1S/C13H10O4/c1-16-11(14)10-9-3-2-8-4-6-13(9,7-5-8)17-12(10)15/h2-8H,1H3
InChIKey ZIZRZGGJRAVQJK-UHFFFAOYSA-N
Mol Weight 230.22 g/mol
Molecular Formula C13H10O4
Exact Mass 230.057909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FLIk2MXkMLC
Name 6,8a-Etheno-8aH-cyclohepta[b]furan-3-carboxylic acid, 2,6-dihydro-2-oxo-, methyl ester
CAS Registry Number 118528-21-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10O4
InChI InChI=1S/C13H10O4/c1-16-11(14)10-9-3-2-8-4-6-13(9,7-5-8)17-12(10)15/h2-8H,1H3
InChIKey ZIZRZGGJRAVQJK-UHFFFAOYSA-N
Molecular Weight 230.219 g/mol
SMILES C=1(C(OC23C1C=CC(C=C3)C=C2)=O)C(=O)OC
SPLASH splash10-00l6-6960000000-56052a77458488eca6f3
Source of Spectrum AJ-62-1140-3
Synonyms 3-(methoxycarbonyl)-2-oxatricyclo[6.2.2.0(1,5)]dodeca-4,6,9,11-tetraen-3-one Methyl 3-oxo-2-oxatricyclo[6.2.2.0(1,5)]dodeca-4,6,9,11-tetraene-4-carboxylate
Wiley ID 1231767