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7H-1,4-Dioxino[2,3-c]xanthen-7-one, 2,3-dihydro-8-hydroxy(3-hydroxy-4-methoxyphenyl)(hydroxymethyl)-5-methoxy-, (2S-trans)-
SpectraBase Compound ID 1WUrvJLRu0i
InChI InChI=1S/C24H20O9/c1-29-15-7-6-11(8-14(15)27)21-18(10-25)32-24-22-12(9-17(30-2)23(24)33-21)20(28)19-13(26)4-3-5-16(19)31-22/h3-9,18,21,25-27H,10H2,1-2H3/t18-,21-/m0/s1
InChIKey WQAYAASFEHKNCW-RXVVDRJESA-N
Mol Weight 452.42 g/mol
Molecular Formula C24H20O9
Exact Mass 452.110732 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZB5iHUDdmk
Name 7H-1,4-Dioxino[2,3-c]xanthen-7-one, 2,3-dihydro-8-hydroxy(3-hydroxy-4-methoxyphenyl)(hydroxymethyl)-5-methoxy-, (2S-trans)-
CAS Registry Number 64280-46-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H20O9
InChI InChI=1S/C24H20O9/c1-29-15-7-6-11(8-14(15)27)21-18(10-25)32-24-22-12(9-17(30-2)23(24)33-21)20(28)19-13(26)4-3-5-16(19)31-22/h3-9,18,21,25-27H,10H2,1-2H3/t18-,21-/m0/s1
InChIKey WQAYAASFEHKNCW-RXVVDRJESA-N
Molecular Weight 452.415 g/mol
SMILES Oc1cccc2c1C(c1c(c3c(O[C@]([C@](CO)(O3)[H])(c3cc(c(OC)cc3)O)[H])c(c1)OC)O2)=O
SPLASH splash10-00e9-0980400000-d1510dfe91d170b92ee5
Source of Spectrum W5-35565-29971-29971
Wiley ID 1388220