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Cinnarubin
SpectraBase Compound ID IoysctCbnin
InChI InChI=1S/C17H12O8/c1-5-9(17(23)24)15(21)12-11(13(5)19)14(20)7-3-6(25-2)4-8(18)10(7)16(12)22/h3-4,18-19,21H,1-2H3,(H,23,24)
InChIKey CNKPMOFLAIXFPC-UHFFFAOYSA-N
Mol Weight 344.27 g/mol
Molecular Formula C17H12O8
Exact Mass 344.053217 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4xuV5fSwSy9
Name Cinnarubin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12O8
InChI InChI=1S/C17H12O8/c1-5-9(17(23)24)15(21)12-11(13(5)19)14(20)7-3-6(25-2)4-8(18)10(7)16(12)22/h3-4,18-19,21H,1-2H3,(H,23,24)
InChIKey CNKPMOFLAIXFPC-UHFFFAOYSA-N
Molecular Weight 344.275 g/mol
SMILES Oc1c2C(c3cc(cc(c3C(c2c(c(C(=O)O)c1C)O)=O)O)OC)=O
SPLASH splash10-004i-0019000000-dba1bcb8589934426553
Source of Spectrum K-105-2926-7
Synonyms 1,4,8-trihydroxy-6-methoxy-3-methyl-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid
Wiley ID 1794751