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1-Hydroxy-6,7,8,9-tetrahydro-5H-benzocycloheptene-3,4-dicarboxylic acid dimethyl ester
SpectraBase Compound ID AvyyyYk5pTT
InChI InChI=1S/C15H18O5/c1-19-14(17)11-8-12(16)9-6-4-3-5-7-10(9)13(11)15(18)20-2/h8,16H,3-7H2,1-2H3
InChIKey ZGXBJVCBIPDBKZ-UHFFFAOYSA-N
Mol Weight 278.3 g/mol
Molecular Formula C15H18O5
Exact Mass 278.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H2XAnGTjcyD
Name 1-Hydroxy-6,7,8,9-tetrahydro-5H-benzocycloheptene-3,4-dicarboxylic acid dimethyl ester
Alternate Name(s) 1-Hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulene-3,4-dicarboxylic acid dimethyl ester Dimethyl 1-hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulene-3,4-dicarboxylate Dimethyl 1-oxidanyl-6,7,8,9-tetrahydro-5H-benzo[7]annulene-3,4-dicarboxylate
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Formula C15H18O5
InChI InChI=1S/C15H18O5/c1-19-14(17)11-8-12(16)9-6-4-3-5-7-10(9)13(11)15(18)20-2/h8,16H,3-7H2,1-2H3
InChIKey ZGXBJVCBIPDBKZ-UHFFFAOYSA-N
Molecular Weight 278.304 g/mol
SMILES Oc1c2CCCCCc2c(c(c1)C(=O)OC)C(=O)OC
SPLASH splash10-00di-9110000000-e0aae2028b0842cc4269
Source of Spectrum J-66-1400-28
Wiley ID 1534603