(2R*,3R*,6R*)-6-[(2S*)-2-acetoxy-4-methylpentyl]-2-(3,3-dimethyl-2-oxobutyl)-3-methyltetrahydropyran - Optional[13C NMR] - Chemical Shifts

SpectraBase Compound ID	A14UhLuoL7O
InChI	InChI=1S/C20H36O4/c1-13(2)10-17(23-15(4)21)11-16-9-8-14(3)18(24-16)12-19(22)20(5,6)7/h13-14,16-18H,8-12H2,1-7H3/t14-,16-,17+,18-/m1/s1
InChIKey	GEKMUBITONZHEV-NRSFXHEJSA-N Google Search
Mol Weight	340.5 g/mol
Molecular Formula	C20H36O4
Exact Mass	340.26136 g/mol

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SpectraBase Spectrum ID	IJx5VfeyGpV
Name	(2R,3R,6R)-6-[(2S)-2-Acetoxy-4-methylpentyl]-2-(3,3-dimethyl-2-oxobutyl)-3-methyltetrahydropyran
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	340.261359635 u
Formula	C20H36O4
InChI	InChI=1S/C20H36O4/c1-13(2)10-17(23-15(4)21)11-16-9-8-14(3)18(24-16)12-19(22)20(5,6)7/h13-14,16-18H,8-12H2,1-7H3/t14-,16-,17+,18-/m1/s1
InChIKey	GEKMUBITONZHEV-NRSFXHEJSA-N
Molecular Weight	340.504 g/mol
SMILES	[C@]1(O[C@](CC[C@]1(C)[H])(C[C@@](OC(=O)C)(CC(C)C)[H])[H])(CC(C(C)(C)C)=O)[H]