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9,10[1',2']-Benzenoanthracene-1,4-dione, 4a-acetyl-4a,9,9a,10-tetrahydro-, cis-(.+-.)-
SpectraBase Compound ID AkOceEIcIve
InChI InChI=1S/C22H16O3/c1-12(23)22-18(25)11-10-17(24)21(22)19-13-6-2-4-8-15(13)20(22)16-9-5-3-7-14(16)19/h2-11,19-21H,1H3
InChIKey CJRLYAZWFOZFTI-UHFFFAOYSA-N
Mol Weight 328.37 g/mol
Molecular Formula C22H16O3
Exact Mass 328.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2EDnI0CIL9
Name 9,10[1',2']-Benzenoanthracene-1,4-dione, 4a-acetyl-4a,9,9a,10-tetrahydro-, cis-(.+-.)-
CAS Registry Number 79755-94-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16O3
InChI InChI=1S/C22H16O3/c1-12(23)22-18(25)11-10-17(24)21(22)19-13-6-2-4-8-15(13)20(22)16-9-5-3-7-14(16)19/h2-11,19-21H,1H3
InChIKey CJRLYAZWFOZFTI-UHFFFAOYSA-N
Molecular Weight 328.367 g/mol
SMILES C12(C3c4ccccc4C(C2C(=O)C=CC1=O)c1ccccc31)C(=O)C
SPLASH splash10-004i-0912000000-76c9ba5eb3d32f4868d5
Source of Spectrum KC-1981-2673-0
Synonyms 2-Acetylpentacyclo[6.6.6.0(2,7).0(9,14).0(15,20)]icosa-4,9,11,13,15,17,19-heptaene-3,6-dione 4a-acetyl-1,4,4a,9,9a,10-hexahydro-9,10-O-benzenoanthracene-1,4-dione
Wiley ID 1326725