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Atromentin
SpectraBase Compound ID Iz2GSv0ubfO
InChI InChI=1S/C18H12O6/c19-11-5-1-9(2-6-11)13-15(21)17(23)14(18(24)16(13)22)10-3-7-12(20)8-4-10/h1-8,19-21,24H
InChIKey FKQQKMGWCJGUCS-UHFFFAOYSA-N
Mol Weight 324.29 g/mol
Molecular Formula C18H12O6
Exact Mass 324.063388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JrLamJwi7iQ
Name 2,5-Cyclohexadiene-1,4-dione, 2,5-dihydroxy-3,6-bis(4-hydroxyphenyl)-
Alternate Name(s) 2,5-Dihydroxy-3,6-bis(4-hydroxyphenyl)benzo-1,4-quinone Atromentin p-Benzoquinone, 2,5-dihydroxy-3,6-bis(p-hydroxyphenyl)- 3,6-bis(4-hydroxyphenyl)cyclohexane-1,2,4,5-tetrone
CAS Registry Number 519-67-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12O6
InChI InChI=1S/C18H12O6/c19-11-5-1-9(2-6-11)13-15(21)17(23)14(18(24)16(13)22)10-3-7-12(20)8-4-10/h1-8,19-21,24H
InChIKey FKQQKMGWCJGUCS-UHFFFAOYSA-N
Molecular Weight 324.288 g/mol
SMILES OC1=C(C(C(=C(c2ccc(cc2)O)C1=O)O)=O)c1ccc(cc1)O
SPLASH splash10-00di-0029000000-60b54a059792e868e1be
Source of Spectrum H-84-3348-1
Wiley ID 847776