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(2R,4S,5S,6S,7R)-6-Ethyl-5,7-isopropylidenedioxy-2,4-dimethylnonanal
SpectraBase Compound ID JPhPnP5wwT7
InChI InChI=1S/C16H30O3/c1-7-13-14(8-2)18-16(5,6)19-15(13)12(4)9-11(3)10-17/h10-15H,7-9H2,1-6H3/t11-,12+,13+,14-,15+/m1/s1
InChIKey VRYNYRZEVXEOMM-FQKPHLNHSA-N
Mol Weight 270.41 g/mol
Molecular Formula C16H30O3
Exact Mass 270.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FcuqWVyxnE8
Name (2R,4S,5S,6S,7R)-6-Ethyl-5,7-isopropylidenedioxy-2,4-dimethylnonanal
Alternate Name(s) (2R,4S)-4-[(4S,5S,6R)-5,6-diethyl-2,2-dimethyl-1,3-dioxan-4-yl]-2-methylpentanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H30O3
InChI InChI=1S/C16H30O3/c1-7-13-14(8-2)18-16(5,6)19-15(13)12(4)9-11(3)10-17/h10-15H,7-9H2,1-6H3/t11-,12+,13+,14-,15+/m1/s1
InChIKey VRYNYRZEVXEOMM-FQKPHLNHSA-N
Molecular Weight 270.413 g/mol
SMILES [C@@]1([C@](C[C@](C=O)(C)[H])(C)[H])([C@@](CC)([C@](OC(C)(O1)C)(CC)[H])[H])[H]
SPLASH splash10-0a4i-9710000000-399da8e14b238f8f9d92
Source of Spectrum E1-37-1720-7
Wiley ID 1517847