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1,8-DI-O-METHYL-ALOE-EMODIN
SpectraBase Compound ID 5279shBw9no
InChI InChI=1S/C17H14O5/c1-21-12-5-3-4-10-14(12)17(20)15-11(16(10)19)6-9(8-18)7-13(15)22-2/h3-7,18H,8H2,1-2H3
InChIKey OTBYRJZRBVFICG-UHFFFAOYSA-N
Mol Weight 298.29 g/mol
Molecular Formula C17H14O5
Exact Mass 298.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AdaiCWWKHHJ
Name 1,8-Dimethoxy-3-methylol-9,10-anthraquinone
CAS Registry Number 50488-95-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14O5
InChI InChI=1S/C17H14O5/c1-21-12-5-3-4-10-14(12)17(20)15-11(16(10)19)6-9(8-18)7-13(15)22-2/h3-7,18H,8H2,1-2H3
InChIKey OTBYRJZRBVFICG-UHFFFAOYSA-N
Molecular Weight 298.294 g/mol
SMILES OCc1cc(c2C(c3c(OC)cccc3C(c2c1)=O)=O)OC
SPLASH splash10-0f89-2690000000-3b32bf79d5649a9e716e
Source of Spectrum J-52-2064-4
Synonyms 3-(hydroxymethyl)-1,8-dimethoxy-anthracene-9,10-dione
Wiley ID 1300957