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Methyl (E)-3-Oxo-2-(3-oxo-3H-isobenzofuran-1-ylidene)butyrate
SpectraBase Compound ID IQxZEtHCvTj
InChI InChI=1S/C13H10O5/c1-7(14)10(13(16)17-2)11-8-5-3-4-6-9(8)12(15)18-11/h3-6H,1-2H3/b11-10+
InChIKey BCKDXRRBPRGIFE-ZHACJKMWSA-N
Mol Weight 246.22 g/mol
Molecular Formula C13H10O5
Exact Mass 246.052823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IV6ng1qbw3a
Name Methyl (E)-3-Oxo-2-(3-oxo-3H-isobenzofuran-1-ylidene)butyrate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10O5
InChI InChI=1S/C13H10O5/c1-7(14)10(13(16)17-2)11-8-5-3-4-6-9(8)12(15)18-11/h3-6H,1-2H3/b11-10+
InChIKey BCKDXRRBPRGIFE-ZHACJKMWSA-N
Molecular Weight 246.218 g/mol
SMILES C(\C(=C\1OC(=O)c2c1cccc2)C(=O)C)(=O)OC
SPLASH splash10-0fk9-2940000000-64fd038be809daba613a
Source of Spectrum F4-43-2285-5a
Wiley ID 1675813