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2',3,3',4',5,7-hexa-acetoxyflavan
SpectraBase Compound ID 9tFBhMHSBth
InChI InChI=1S/C27H26O13/c1-12(28)34-18-9-22(36-14(3)30)20-11-24(37-15(4)31)25(40-23(20)10-18)19-7-8-21(35-13(2)29)27(39-17(6)33)26(19)38-16(5)32/h7-10,24-25H,11H2,1-6H3
InChIKey AYEKBUFQPKVGCK-UHFFFAOYSA-N
Mol Weight 558.49 g/mol
Molecular Formula C27H26O13
Exact Mass 558.137341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7y5iuCOQSxo
Name 2',3,3',4',5,7-hexa-acetoxyflavan
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H26O13
InChI InChI=1S/C27H26O13/c1-12(28)34-18-9-22(36-14(3)30)20-11-24(37-15(4)31)25(40-23(20)10-18)19-7-8-21(35-13(2)29)27(39-17(6)33)26(19)38-16(5)32/h7-10,24-25H,11H2,1-6H3
InChIKey AYEKBUFQPKVGCK-UHFFFAOYSA-N
Molecular Weight 558.492 g/mol
SMILES c1(c(C2Oc3cc(OC(=O)C)cc(c3CC2OC(=O)C)OC(=O)C)ccc(c1OC(=O)C)OC(=O)C)OC(=O)C
SPLASH splash10-06ya-0827900000-bfca359bdae1792013dd
Source of Spectrum KC-1988-225-10
Synonyms 2,3-bis(acetyloxy)-4-[3,5,7-tris(acetyloxy)-3,4-dihydro-2H-chromen-2-yl]phenyl acetate
Wiley ID 1406546