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6,8a-Etheno-8aH-cyclohepta[b]furan-3-carboxylic acid, 5-chloro-2,6-dihydro-2-oxo-, methyl ester
SpectraBase Compound ID KraZTcMKGCi
InChI InChI=1S/C13H9ClO4/c1-17-11(15)10-8-6-9(14)7-2-4-13(8,5-3-7)18-12(10)16/h2-7H,1H3
InChIKey WOOKCUJINLTHLA-UHFFFAOYSA-N
Mol Weight 264.66 g/mol
Molecular Formula C13H9ClO4
Exact Mass 264.018936 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IeORCQADimN
Name 6,8a-Etheno-8aH-cyclohepta[b]furan-3-carboxylic acid, 5-chloro-2,6-dihydro-2-oxo-, methyl ester
CAS Registry Number 118528-26-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9ClO4
InChI InChI=1S/C13H9ClO4/c1-17-11(15)10-8-6-9(14)7-2-4-13(8,5-3-7)18-12(10)16/h2-7H,1H3
InChIKey WOOKCUJINLTHLA-UHFFFAOYSA-N
Molecular Weight 264.664 g/mol
SMILES C12=C(C(=O)OC22C=CC(C(=C1)Cl)C=C2)C(=O)OC
SPLASH splash10-004j-0590000000-64b06defe9855d69637e
Source of Spectrum AJ-62-1140-3
Synonyms 7-Chloro-2-oxatricyclo[6.2.2.0(1,5)]dodeca-4,6,9,11-tetraen-3-one Methyl 7-chloro-3-oxo-2-oxatricyclo[6.2.2.0(1,5)]dodeca-4,6,9,11-tetraene-4-carboxylate
Wiley ID 1267611