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3-Flavanol, 4-ethoxy-3',4',7-trimethoxy-, acetate, trans-2,3,trans-3,4-
SpectraBase Compound ID 7vM2R29sIhj
InChI InChI=1S/C22H26O7/c1-6-27-21-16-9-8-15(24-3)12-18(16)29-20(22(21)28-13(2)23)14-7-10-17(25-4)19(11-14)26-5/h7-12,20-22H,6H2,1-5H3
InChIKey WWONCZBNRAARPG-UHFFFAOYSA-N
Mol Weight 402.44 g/mol
Molecular Formula C22H26O7
Exact Mass 402.167853 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HKAsIekdlX1
Name 3-Flavanol, 4-ethoxy-3',4',7-trimethoxy-, acetate, trans-2,3,trans-3,4-
Alternate Name(s) 2-(3,4-Dimethoxyphenyl)-4-ethoxy-7-methoxy-3,4-dihydro-2H-chromen-3-yl acetate Acetic acid [2-(3,4-dimethoxyphenyl)-4-ethoxy-7-methoxy-3,4-dihydro-2H-1-benzopyran-3-yl] ester [2-(3,4-dimethoxyphenyl)-4-ethoxy-7-methoxy-3,4-dihydro-2H-chromen-3-yl] acetate [2-(3,4-dimethoxyphenyl)-4-ethoxy-7-methoxy-chroman-3-yl] acetate [2-(3,4-dimethoxyphenyl)-4-ethoxy-7-methoxy-3,4-dihydro-2H-chromen-3-yl] ethanoate
CAS Registry Number 16821-17-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O7
InChI InChI=1S/C22H26O7/c1-6-27-21-16-9-8-15(24-3)12-18(16)29-20(22(21)28-13(2)23)14-7-10-17(25-4)19(11-14)26-5/h7-12,20-22H,6H2,1-5H3
InChIKey WWONCZBNRAARPG-UHFFFAOYSA-N
Molecular Weight 402.443 g/mol
SMILES CCOC1c2ccc(cc2OC(c2ccc(c(c2)OC)OC)C1OC(C)=O)OC
SPLASH splash10-001j-0961000000-620e1cb2fa93c20c905a
Source of Spectrum B-21-3043-29
Wiley ID 1370336