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3,8-Dihydroxy-3,4,4a,5,6,12b-hexahydro-3-methyl-2H-benz[a]anthracene-1,7,12-trione
SpectraBase Compound ID 8QVwlhEFtT5
InChI InChI=1S/C19H18O5/c1-19(24)7-9-5-6-11-16(14(9)13(21)8-19)18(23)10-3-2-4-12(20)15(10)17(11)22/h2-4,9,14,20,24H,5-8H2,1H3
InChIKey BNHNAYRFJYIFGH-UHFFFAOYSA-N
Mol Weight 326.35 g/mol
Molecular Formula C19H18O5
Exact Mass 326.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21CGl4qAEQv
Name 3,8-Dihydroxy-3,4,4a,5,6,12b-hexahydro-3-methyl-2H-benz[a]anthracene-1,7,12-trione
Alternate Name(s) 3,8-Dihydroxy-3-methyl-3,4,4a,5,6,12b-hexahydrobenzo[a]anthracene-1,7,12(2H)-trione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18O5
InChI InChI=1S/C19H18O5/c1-19(24)7-9-5-6-11-16(14(9)13(21)8-19)18(23)10-3-2-4-12(20)15(10)17(11)22/h2-4,9,14,20,24H,5-8H2,1H3
InChIKey BNHNAYRFJYIFGH-UHFFFAOYSA-N
Molecular Weight 326.348 g/mol
SMILES Oc1c2C(C3=C(C4C(CC(CC4=O)(C)O)CC3)C(c2ccc1)=O)=O
SPLASH splash10-004i-0019000000-031687b619809941e318
Source of Spectrum K1-2000-1631-11
Wiley ID 750139