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1,4-Dihydroxyanthraquinone
SpectraBase Compound ID FZhQ6DsV6RF
InChI InChI=1S/C14H8O4/c15-9-5-6-10(16)12-11(9)13(17)7-3-1-2-4-8(7)14(12)18/h1-6,15-16H
InChIKey GUEIZVNYDFNHJU-UHFFFAOYSA-N
Mol Weight 240.21 g/mol
Molecular Formula C14H8O4
Exact Mass 240.042259 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 5hAOfS5EWxT
Name 1,4-Dihydroxyanthraquinone
CAS Registry Number 81-64-1
Collision Energy 30 eV
Copyright Copyright © 2012-2025 Herbert Oberacher. All Rights Reserved.
Exact Mass 240.042258734 u
Formula C14H8O4
InChI InChI=1S/C14H8O4/c15-9-5-6-10(16)12-11(9)13(17)7-3-1-2-4-8(7)14(12)18/h1-6,15-16H
InChIKey GUEIZVNYDFNHJU-UHFFFAOYSA-N
Instrument Name QStar XL, AB Sciex
Ion Polarity P
Ionization Type ESI+
Molecular Weight 240.214 g/mol
Nominal Mass 240 u
Precursor Ion [M+H]+
Precursor m/z 241.05
SMILES OC1=C2C(=C(O)C=C1)C(C=1C(C2=O)=CC=CC1)=O
Selected Ion Charge 1
Source of Spectrum Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria
Spectrum Type ms2
Synonyms 1,4-dihydroxyanthracene-9,10-dione
Technique Q-TOF
Wiley ID MSforID_+_832.9