(3S)-3-[(1S,2R,3S,4S)-1,3,5-tribenzoxy-2,4-dimethyl-pentyl]-1,4-dioxaspiro[4.5]decane

SpectraBase Compound ID	3me8lV008R1
InChI	InChI=1S/C36H46O5/c1-28(23-37-24-30-15-7-3-8-16-30)34(38-25-31-17-9-4-10-18-31)29(2)35(39-26-32-19-11-5-12-20-32)33-27-40-36(41-33)21-13-6-14-22-36/h3-5,7-12,15-20,28-29,33-35H,6,13-14,21-27H2,1-2H3/t28-,29+,33-,34-,35-/m0/s1
InChIKey	GVPJRSSPMRONHR-UTHVZROHSA-N Google Search
Mol Weight	558.8 g/mol
Molecular Formula	C36H46O5
Exact Mass	558.334525 g/mol

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SpectraBase Spectrum ID	GiqizOwzcAu
Name	(3S)-3-[(1S,2R,3S,4S)-1,3,5-tribenzoxy-2,4-dimethyl-pentyl]-1,4-dioxaspiro[4.5]decane
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C36H46O5
InChI	InChI=1S/C36H46O5/c1-28(23-37-24-30-15-7-3-8-16-30)34(38-25-31-17-9-4-10-18-31)29(2)35(39-26-32-19-11-5-12-20-32)33-27-40-36(41-33)21-13-6-14-22-36/h3-5,7-12,15-20,28-29,33-35H,6,13-14,21-27H2,1-2H3/t28-,29+,33-,34-,35-/m0/s1
InChIKey	GVPJRSSPMRONHR-UTHVZROHSA-N
Molecular Weight	558.759 g/mol
SMILES	[C@]1(OC2(OC1)CCCCC2)([C@]([C@@]([C@]([C@](COCc1ccccc1)(C)[H])(OCc1ccccc1)[H])(C)[H])(OCc1ccccc1)[H])[H]
SPLASH	splash10-0006-9310000000-087522f86b4fc97dc555
Source of Spectrum	F-70-8138-15
Synonyms	(3S)-3-[(1S,2R,3S,4S)-1,3,5-tribenzyloxy-2,4-dimethyl-pentyl]-1,4-dioxaspiro[4.5]decane (3S)-3-[(1S,2R,3S,4S)-2,4-dimethyl-1,3,5-tris(phenylmethoxy)pentyl]-1,4-dioxaspiro[4.5]decane
Wiley ID	1597522