.alpha.-D-Glucopyranoside, [1,1'-biphenyl]-4-yl, tetraacetate

SpectraBase Compound ID	8dissRb4j7H
InChI	InChI=1S/C26H28O10/c1-15(27)31-14-22-23(32-16(2)28)24(33-17(3)29)25(34-18(4)30)26(36-22)35-21-12-10-20(11-13-21)19-8-6-5-7-9-19/h5-13,22-26H,14H2,1-4H3/t22-,23-,24+,25-,26-/m1/s1
InChIKey	KLBBFLZPOGVHGX-WSGIOKLISA-N Google Search
Mol Weight	500.5 g/mol
Molecular Formula	C26H28O10
Exact Mass	500.168247 g/mol

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SpectraBase Spectrum ID	82vicOpHfa9
Name	.alpha.-D-Glucopyranoside, [1,1'-biphenyl]-4-yl, tetraacetate
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	500.168247092 u
Formula	C26H28O10
InChI	InChI=1S/C26H28O10/c1-15(27)31-14-22-23(32-16(2)28)24(33-17(3)29)25(34-18(4)30)26(36-22)35-21-12-10-20(11-13-21)19-8-6-5-7-9-19/h5-13,22-26H,14H2,1-4H3/t22-,23-,24+,25-,26-/m1/s1
InChIKey	KLBBFLZPOGVHGX-WSGIOKLISA-N
Molecular Weight	500.500 g/mol
SMILES	[C@@]1([C@]([C@](OC(=O)C)([C@](O[C@]1(OC1=CC=C(C=C1)C=1C=CC=CC1)[H])(COC(=O)C)[H])[H])(OC(=O)C)[H])(OC(=O)C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR)	0.976307