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Anthraquinone
SpectraBase Compound ID 9A26HDYigh7
InChI InChI=1S/C14H8O2/c15-13-9-5-1-2-6-10(9)14(16)12-8-4-3-7-11(12)13/h1-8H
InChIKey RZVHIXYEVGDQDX-UHFFFAOYSA-N
Mol Weight 208.22 g/mol
Molecular Formula C14H8O2
Exact Mass 208.052429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jo91exoFtCc
Name Anthraquinone
CAS Registry Number 84-65-1
Classification Pharmaceutical drug artifact
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 208.052429496 u
Formula C14H8O2
InChI InChI=1S/C14H8O2/c15-13-9-5-1-2-6-10(9)14(16)12-8-4-3-7-11(12)13/h1-8H
InChIKey RZVHIXYEVGDQDX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 208.216 g/mol
Nominal Mass 208 u
Quality 977
Retention Index 1927
SMILES C=12C(C(C3=C(C2=O)C=CC=C3)=O)=CC=CC1
SPLASH splash10-0ue9-4920000000-483826f8a70f3710a4ef
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Doxepine-A 9,10-Anthracenedione
Technique GC/MS
Wiley ID DD2024_020391