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3,6,8-trihydroxy-3-methyl-2,4-dihydro-1H-benzo[a]anthracene-7,12-dione
SpectraBase Compound ID JU957ZE57Bf
InChI InChI=1S/C19H16O5/c1-19(24)6-5-10-9(8-19)7-13(21)16-15(10)17(22)11-3-2-4-12(20)14(11)18(16)23/h2-4,7,20-21,24H,5-6,8H2,1H3
InChIKey SQAXJOBYVYRMMO-UHFFFAOYSA-N
Mol Weight 324.33 g/mol
Molecular Formula C19H16O5
Exact Mass 324.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2WlyH3Mvc8
Name 3,6,8-trihydroxy-3-methyl-2,4-dihydro-1H-benzo[a]anthracene-7,12-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16O5
InChI InChI=1S/C19H16O5/c1-19(24)6-5-10-9(8-19)7-13(21)16-15(10)17(22)11-3-2-4-12(20)14(11)18(16)23/h2-4,7,20-21,24H,5-6,8H2,1H3
InChIKey SQAXJOBYVYRMMO-UHFFFAOYSA-N
Molecular Weight 324.332 g/mol
SMILES Oc1c2C(c3c(c4c(cc3O)CC(CC4)(C)O)C(c2ccc1)=O)=O
SPLASH splash10-0abc-0049000000-53fb3d850f39f6fcdb0c
Source of Spectrum U-1994-477-19
Synonyms 3,6,8-trihydroxy-3-methyl-2,4-dihydro-1H-benz[a]anthracene-7,12-quinone 3-Methyl-3,6,8-tris(oxidanyl)-2,4-dihydro-1H-benzo[a]anthracene-7,12-dione
Wiley ID 765800