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(2R*,3S*,6S*)-6-[(2R*)-2-acetoxy-4-methylpentyl]-2-(3,3-dimethyl-2-oxobutyl)-3-methyltetrahydropyran
SpectraBase Compound ID Czqr5KaGNUI
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+/m0/s1
InChIKey GEKMUBITONZHEV-DZJNRPSUSA-N
Mol Weight 340.5 g/mol
Molecular Formula C20H36O4
Exact Mass 340.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FU1sCL5BlN4
Name (2R*,3S*,6S*)-6-[(2R*)-2-acetoxy-4-methylpentyl]-2-(3,3-dimethyl-2-oxobutyl)-3-methyltetrahydropyran
CAS Registry Number 117270-56-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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+/m0/s1
InChIKey GEKMUBITONZHEV-DZJNRPSUSA-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]
SPLASH splash10-000x-0390000000-d0cb64e7669f2564c652
Source of Spectrum J-54-107-35
Synonyms (1R)-1-{[(2S,5S,6R)-6-(3,3-dimethyl-2-oxobutyl)-5-methyltetrahydro-2H-pyran-2-yl]methyl}-3-methylbutyl acetate
Wiley ID 1335357