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7-oxo-7H-benzocycloheptene-6,6-dicarboxylic acid, dimethyl ester
SpectraBase Compound ID Bm0hkgDDwlQ
InChI InChI=1S/C15H12O5/c1-19-14(17)11-7-9-5-3-4-6-10(9)8-12(13(11)16)15(18)20-2/h3-8H,1-2H3
InChIKey DCTQUEIYCQWNRS-UHFFFAOYSA-N
Mol Weight 272.26 g/mol
Molecular Formula C15H12O5
Exact Mass 272.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4yem1NNXFof
Name 7-Oxo-7H-benzocycloheptene-6,8-dicarboxylic acid, dimethyl ester
Alternate Name(s) 7-ketobenzocycloheptene-6,8-dicarboxylic acid dimethyl ester 7-Oxobenzo[7]annulene-6,8-dicarboxylic acid dimethyl ester Dimethyl 7-oxidanylidenebenzo[7]annulene-6,8-dicarboxylate Dimethyl 7-oxo-7H-benzo[a]cycloheptene-6,8-dicarboxylate Dimethyl 7-oxobenzo[7]annulene-6,8-dicarboxylate
CAS Registry Number 24790-67-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12O5
InChI InChI=1S/C15H12O5/c1-19-14(17)11-7-9-5-3-4-6-10(9)8-12(13(11)16)15(18)20-2/h3-8H,1-2H3
InChIKey DCTQUEIYCQWNRS-UHFFFAOYSA-N
Molecular Weight 272.256 g/mol
SMILES C(=O)(C=1C(C(=Cc2ccccc2C1)C(=O)OC)=O)OC
SPLASH splash10-03dl-2690000000-ee43a84726094efd9f54
Wiley ID 1475642