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1,5-Dimethoxy-2-(2'-oxopropyl)-6-(prop-1''-ynyl)anthraquinone
SpectraBase Compound ID 6vNkaG6TedT
InChI InChI=1S/C22H18O5/c1-5-6-13-7-9-15-17(21(13)26-3)19(24)16-10-8-14(11-12(2)23)22(27-4)18(16)20(15)25/h7-10H,11H2,1-4H3
InChIKey OFSKPNVIKBSGCG-UHFFFAOYSA-N
Mol Weight 362.38 g/mol
Molecular Formula C22H18O5
Exact Mass 362.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5pf52jYuxum
Name 1,5-Dimethoxy-2-(2'-oxopropyl)-6-(prop-1''-ynyl)anthraquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18O5
InChI InChI=1S/C22H18O5/c1-5-6-13-7-9-15-17(21(13)26-3)19(24)16-10-8-14(11-12(2)23)22(27-4)18(16)20(15)25/h7-10H,11H2,1-4H3
InChIKey OFSKPNVIKBSGCG-UHFFFAOYSA-N
Molecular Weight 362.381 g/mol
SMILES c12C(c3ccc(C#CC)c(c3C(c2ccc(c1OC)CC(=O)C)=O)OC)=O
SPLASH splash10-0bu0-0009000000-2388c314575d02ab540f
Source of Spectrum B-48-1089-0
Synonyms 1,5-Dimethoxy-2-(2'-oxopropyl)-6-(prop-1''-ynyl)anthraquinone 1,5-Dimethoxy-2-(2-oxopropyl)-6-(1-propynyl)anthra-9,10-quinone
Wiley ID 1349786