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3H-Cycloocta[de]naphthalene-8,10-dicarboxylic acid, 7,8,9,11a-tetrahydro-11-hydroxy-7-oxo-, dimethyl ester
SpectraBase Compound ID K4Zj77IbC3N
InChI InChI=1S/C19H18O6/c1-24-18(22)13-9-14(19(23)25-2)17(21)12-8-4-6-10-5-3-7-11(15(10)12)16(13)20/h3-5,7-8,12-13,21H,6,9H2,1-2H3/b17-14-
InChIKey ULBDSFYFQGCOLM-VKAVYKQESA-N
Mol Weight 342.35 g/mol
Molecular Formula C19H18O6
Exact Mass 342.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8w08G8wyWsu
Name 3H-Cycloocta[de]naphthalene-8,10-dicarboxylic acid, 7,8,9,11a-tetrahydro-11-hydroxy-7-oxo-, dimethyl ester
Alternate Name(s) 1,4-Dihydro-(2',4'-dimethoxycarbonyl-5'-hydroxy-1'-oxo-cycloocat-10-eno[6',7',8'-ij]naphthalene dimethyl 11-hydroxy-7-oxo-7,8,9,11a-tetrahydro-3H-cycloocta[de]naphthalene-8,10-dicarboxylate
CAS Registry Number 121691-43-8
Comments Less than 3 mono-isotopic peaks
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Formula C19H18O6
InChI InChI=1S/C19H18O6/c1-24-18(22)13-9-14(19(23)25-2)17(21)12-8-4-6-10-5-3-7-11(15(10)12)16(13)20/h3-5,7-8,12-13,21H,6,9H2,1-2H3/b17-14-
InChIKey ULBDSFYFQGCOLM-VKAVYKQESA-N
Molecular Weight 342.347 g/mol
SMILES O\C1=C\(CC(C(c2cccc3c2C1C=CC3)=O)C(=O)OC)C(=O)OC
SPLASH splash10-004i-0900000000-fc7ef8d0e75d31139714
Source of Spectrum KC-1989-218-13
Wiley ID 1336530