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Benzoic acid, 2-hydroxy-4-[[2-hydroxy-4-methoxy-6-(2-oxopentyl)benzoyl]oxy]-6-(2-oxopentyl)-, phenylmethyl ester
SpectraBase Compound ID LvYpTt3MsZ3
InChI InChI=1S/C32H34O9/c1-4-9-23(33)13-21-15-25(39-3)17-27(35)30(21)32(38)41-26-16-22(14-24(34)10-5-2)29(28(36)18-26)31(37)40-19-20-11-7-6-8-12-20/h6-8,11-12,15-18,35-36H,4-5,9-10,13-14,19H2,1-3H3
InChIKey UGSLLXFYWWOBJY-UHFFFAOYSA-N
Mol Weight 562.6 g/mol
Molecular Formula C32H34O9
Exact Mass 562.220283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXfTl6lIgXE
Name Benzoic acid, 2-hydroxy-4-[[2-hydroxy-4-methoxy-6-(2-oxopentyl)benzoyl]oxy]-6-(2-oxopentyl)-, phenylmethyl ester
CAS Registry Number 127743-52-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H34O9
InChI InChI=1S/C32H34O9/c1-4-9-23(33)13-21-15-25(39-3)17-27(35)30(21)32(38)41-26-16-22(14-24(34)10-5-2)29(28(36)18-26)31(37)40-19-20-11-7-6-8-12-20/h6-8,11-12,15-18,35-36H,4-5,9-10,13-14,19H2,1-3H3
InChIKey UGSLLXFYWWOBJY-UHFFFAOYSA-N
Molecular Weight 562.615 g/mol
SMILES Oc1cc(OC(c2c(cc(cc2CC(=O)CCC)OC)O)=O)cc(c1C(OCc1ccccc1)=O)CC(=O)CCC
SPLASH splash10-0006-9000000000-57841d641bd4ad342fba
Source of Spectrum B-42-1980-41
Synonyms 4-[(benzyloxy)carbonyl]-3-hydroxy-5-(2-oxopentyl)phenyl 2-hydroxy-4-methoxy-6-(2-oxopentyl)benzoate Benzyl 2-(propylcarbonylmethyl)-4-(4'-benzyloxy-6'-(propylcarbonylmethyl)-2'-hydroxybenzoyloxy)-6-hydroxybenzoate Benzyl glomellate
Wiley ID 1406949