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2H-1-Benzopyran-5,7-diol, 3,4-dihydro-2-(4-hydroxyphenyl)-, 7-acetate
SpectraBase Compound ID I70ftPf61Xw
InChI InChI=1S/C17H16O5/c1-10(18)21-13-8-15(20)14-6-7-16(22-17(14)9-13)11-2-4-12(19)5-3-11/h2-5,8-9,16,19-20H,6-7H2,1H3
InChIKey CARASBGVGQAEFC-UHFFFAOYSA-N
Mol Weight 300.31 g/mol
Molecular Formula C17H16O5
Exact Mass 300.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LPo2DVdA0Dg
Name 2H-1-Benzopyran-5,7-diol, 3,4-dihydro-2-(4-hydroxyphenyl)-, 7-acetate
Alternate Name(s) 4',7-Dihydroxy-7-acetoxyflavan 5-Hydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-yl acetate
CAS Registry Number 66313-00-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O5
InChI InChI=1S/C17H16O5/c1-10(18)21-13-8-15(20)14-6-7-16(22-17(14)9-13)11-2-4-12(19)5-3-11/h2-5,8-9,16,19-20H,6-7H2,1H3
InChIKey CARASBGVGQAEFC-UHFFFAOYSA-N
Molecular Weight 300.310 g/mol
SMILES Oc1ccc(C2Oc3c(c(cc(c3)OC(=O)C)O)CC2)cc1
SPLASH splash10-05g3-8922000000-c3bbc6324c422df83ef3
Source of Spectrum F-33-2931-0
Wiley ID 1302882