| SpectraBase Spectrum ID |
JGA7KJZxpVw |
| 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 |
903 |
| Retention Index |
1927 |
| SMILES |
C=12C(C(C3=C(C2=O)C=CC=C3)=O)=CC=CC1 |
| SPLASH |
splash10-0zgi-0940000000-757869912081178766c0 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Doxepine-A
9,10-Anthracenedione |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000173 |
