[(2R,3R,4S,5R,6S)-3,4,5-triacetoxy-6-[(1,4-dioxo-2-naphthyl)oxy]tetrahydropyran-2-yl]methyl acetate

SpectraBase Compound ID	2WoIduD8ZWZ
InChI	InChI=1S/C24H24O12/c1-11(25)31-10-19-21(32-12(2)26)22(33-13(3)27)23(34-14(4)28)24(36-19)35-18-9-17(29)15-7-5-6-8-16(15)20(18)30/h5-9,19,21-24H,10H2,1-4H3/t19-,21-,22+,23-,24-/m1/s1
InChIKey	PCIKOXAOUDWGHD-PFKOEMKTSA-N Google Search
Mol Weight	504.44 g/mol
Molecular Formula	C24H24O12
Exact Mass	504.126776 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	xqRCCGKTOn
Name	[(2R,3R,4S,5R,6S)-3,4,5-Triacetoxy-6-[(1,4-dioxo-2-naphthyl)oxy]tetrahydropyran-2-yl]methyl acetate
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	504.126776201 u
Formula	C24H24O12
InChI	InChI=1S/C24H24O12/c1-11(25)31-10-19-21(32-12(2)26)22(33-13(3)27)23(34-14(4)28)24(36-19)35-18-9-17(29)15-7-5-6-8-16(15)20(18)30/h5-9,19,21-24H,10H2,1-4H3/t19-,21-,22+,23-,24-/m1/s1
InChIKey	PCIKOXAOUDWGHD-PFKOEMKTSA-N
Molecular Weight	504.444 g/mol
SMILES	[C@@]1([C@]([C@](OC(=O)C)([C@](O[C@]1(OC1=CC(=O)C2=C(C1=O)C=CC=C2)[H])(COC(=O)C)[H])[H])(OC(=O)C)[H])(OC(=O)C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR)	0.956588