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3-Methoxy-9-oxo-5,7,8,9-tetrahydro-6H-benzo[7]annulene-6,6-dicarboxylic acid
SpectraBase Compound ID 60RJM8cInWA
InChI InChI=1S/C14H14O6/c1-20-9-2-3-10-8(6-9)7-14(12(16)17,13(18)19)5-4-11(10)15/h2-3,6H,4-5,7H2,1H3,(H,16,17)(H,18,19)
InChIKey CYCWVANPXJKOCE-UHFFFAOYSA-N
Mol Weight 278.26 g/mol
Molecular Formula C14H14O6
Exact Mass 278.079038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2B8qVgQ7S0g
Name 3-Methoxy-9-oxo-5,7,8,9-tetrahydro-6H-benzo[7]annulene-6,6-dicarboxylic acid
Alternate Name(s) 6H-Benzocycloheptene-6,6-dicarboxylic acid, 5,7,8,9-tetrahydro-3-methoxy-9-oxo- 3-Methoxy-9-oxo-7,8-dihydro-5H-benzo[7]annulene-6,6-dicarboxylic acid 3-Methoxy-9-oxidanylidene-7,8-dihydro-5H-benzo[7]annulene-6,6-dicarboxylic acid
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Formula C14H14O6
InChI InChI=1S/C14H14O6/c1-20-9-2-3-10-8(6-9)7-14(12(16)17,13(18)19)5-4-11(10)15/h2-3,6H,4-5,7H2,1H3,(H,16,17)(H,18,19)
InChIKey CYCWVANPXJKOCE-UHFFFAOYSA-N
Molecular Weight 278.260 g/mol
SMILES OC(C1(C(=O)O)Cc2c(ccc(c2)OC)C(CC1)=O)=O
SPLASH splash10-03di-5900000000-e7cf4fdecf935ad7325f
Source of Spectrum IY-1-4272-5
Wiley ID 1650717