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2,2'-[(4-Ethylphenyl)methylene]bis[3-hydroxy-6-(hydroxymethyl)-4H-pyran-4-one]
SpectraBase Compound ID 6M4F651pX7Z
InChI InChI=1S/C21H20O8/c1-2-11-3-5-12(6-4-11)17(20-18(26)15(24)7-13(9-22)28-20)21-19(27)16(25)8-14(10-23)29-21/h3-8,17,22-23,26-27H,2,9-10H2,1H3
InChIKey MHGXASALTZTILJ-UHFFFAOYSA-N
Mol Weight 400.38 g/mol
Molecular Formula C21H20O8
Exact Mass 400.115818 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1sx6cPjS4m
Name 2,2'-[(4-Ethylphenyl)methylene]bis[3-hydroxy-6-(hydroxymethyl)-4H-pyran-4-one]
Appearance Yellowish powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20O8
InChI InChI=1S/C21H20O8/c1-2-11-3-5-12(6-4-11)17(20-18(26)15(24)7-13(9-22)28-20)21-19(27)16(25)8-14(10-23)29-21/h3-8,17,22-23,26-27H,2,9-10H2,1H3
InChIKey MHGXASALTZTILJ-UHFFFAOYSA-N
Instrument Name Kratos MS-30
Ionization Type EI
Literature Reference DOI 10.24820/ark.5550190.p011.217
Molecular Weight 400.383 g/mol
Reported Formula C21H20O8
SMILES OCC1=CC(C(=C(C(C=2OC(=CC(C2O)=O)CO)c2ccc(cc2)CC)O1)O)=O
SPLASH splash10-0a4l-3960000000-5eceec068517b1abaf4b
Source of Spectrum ARK-2020-208-2c
Wiley ID 1860378