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4',5,7-flavantriol, triacetate
SpectraBase Compound ID 6UhqvebzTCT
InChI InChI=1S/C21H20O7/c1-12(22)25-16-6-4-15(5-7-16)19-9-8-18-20(27-14(3)24)10-17(26-13(2)23)11-21(18)28-19/h4-7,10-11,19H,8-9H2,1-3H3
InChIKey HOYRCSCCZZMKKV-UHFFFAOYSA-N
Mol Weight 384.38 g/mol
Molecular Formula C21H20O7
Exact Mass 384.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FGntnBIDuDU
Name 2H-1-Benzopyran-5,7-diol, 2-[4-(acetyloxy)phenyl]-3,4-dihydro-, diacetate
CAS Registry Number 64670-92-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20O7
InChI InChI=1S/C21H20O7/c1-12(22)25-16-6-4-15(5-7-16)19-9-8-18-20(27-14(3)24)10-17(26-13(2)23)11-21(18)28-19/h4-7,10-11,19H,8-9H2,1-3H3
InChIKey HOYRCSCCZZMKKV-UHFFFAOYSA-N
Molecular Weight 384.384 g/mol
SMILES c12c(c(OC(=O)C)cc(c2)OC(=O)C)CCC(O1)c1ccc(OC(=O)C)cc1
SPLASH splash10-0006-9214000000-8ce8f6ec3a48b70c2c28
Source of Spectrum F-33-2930-0
Synonyms 4',5,m-triacetoxyflavan 5-(acetyloxy)-2-[4-(acetyloxy)phenyl]-3,4-dihydro-2H-chromen-7-yl acetate Acetic acid[4-(5,7-diacetoxychroman-2-yl)phenyl]ester Acetic acid[4-(5,7-diacetyloxy-3,4-dihydro-2H-1-benzopyran-2-yl)phenyl]ester [4-(5,7-diacetoxychroman-2-yl)phenyl]acetate [4-(5,7-diacetyloxy-3,4-dihydro-2H-chromen-2-yl)phenyl]acetate [4-(5,7-diacetyloxy-3,4-dihydro-2H-chromen-2-yl)phenyl]ethanoate Acetic acid [4-(5,7-diacetyloxy-3,4-dihydro-2H-1-benzopyran-2-yl)phenyl] ester [4-(5,7-diacetyloxy-3,4-dihydro-2H-chromen-2-yl)phenyl] acetate [4-(5,7-diacetoxychroman-2-yl)phenyl] acetate [4-(5,7-diacetyloxy-3,4-dihydro-2H-chromen-2-yl)phenyl] ethanoate
Wiley ID 1361503