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9-Formyl-1,4,9,10-tetrahydro-9,10-(o-benzeno)anthracene-1,4-dione
SpectraBase Compound ID 417vAcBn4qm
InChI InChI=1S/C21H12O3/c22-11-21-14-7-3-1-5-12(14)18(13-6-2-4-8-15(13)21)19-16(23)9-10-17(24)20(19)21/h1-11,18H/t18-,21+
InChIKey PGEOLIKJSXVNTN-RVWIWJKTSA-N
Mol Weight 312.32 g/mol
Molecular Formula C21H12O3
Exact Mass 312.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Le6FF136ksB
Name 9-Formyl-1,4,9,10-tetrahydro-9,10-(o-benzeno)anthracene-1,4-dione
Alternate Name(s) 16,19-dioxopentacyclo[6.6.6.0(2,7).0(9,14).0(15,20)]icosa-2,4,6,9,11,13,15(20),17-octaene-1-carbaldehyde
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Formula C21H12O3
InChI InChI=1S/C21H12O3/c22-11-21-14-7-3-1-5-12(14)18(13-6-2-4-8-15(13)21)19-16(23)9-10-17(24)20(19)21/h1-11,18H/t18-,21+
InChIKey PGEOLIKJSXVNTN-RVWIWJKTSA-N
Molecular Weight 312.324 g/mol
SMILES [C@]12(C3=C(C(=O)C=CC3=O)[C@@](c3c1cccc3)(c1c2cccc1)[H])C=O
SPLASH splash10-08gi-0094000000-cfd29a10bf1b1a8e2fa4
Source of Spectrum F-57-10102-58
Wiley ID 1626679