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(6R,4'S)-6-(2,2-Dimethyl-1,3-dioxolan-4-yl)-6-undecyltetrahydropyran-2-one
SpectraBase Compound ID 9NmgVQkZZce
InChI InChI=1S/C21H38O4/c1-4-5-6-7-8-9-10-11-12-15-21(16-13-14-19(22)25-21)18-17-23-20(2,3)24-18/h18H,4-17H2,1-3H3/t18-,21+/m0/s1
InChIKey IBOHAGOJKTYASD-GHTZIAJQSA-N
Mol Weight 354.5 g/mol
Molecular Formula C21H38O4
Exact Mass 354.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L9vChTE1ET9
Name (6R,4'S)-6-(2,2-Dimethyl-1,3-dioxolan-4-yl)-6-undecyltetrahydropyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H38O4
InChI InChI=1S/C21H38O4/c1-4-5-6-7-8-9-10-11-12-15-21(16-13-14-19(22)25-21)18-17-23-20(2,3)24-18/h18H,4-17H2,1-3H3/t18-,21+/m0/s1
InChIKey IBOHAGOJKTYASD-GHTZIAJQSA-N
Molecular Weight 354.531 g/mol
SMILES [C@]1(OC(OC1)(C)C)([C@@]1(OC(=O)CCC1)CCCCCCCCCCC)[H]
SPLASH splash10-0udi-0393000000-677e48fe1f2196524507
Source of Spectrum F-59-860-16
Synonyms (6R)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-6-undecyl-2-oxanone (6R)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-6-undecyloxan-2-one (6R)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-6-undecyl-oxan-2-one
Wiley ID 1676894