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(RS)-(2S,3R,4R)-2-Methyl-4-(5-methylhexyl)-5-oxotetrahydrofuran-3-yl 2-methylbutanoate
SpectraBase Compound ID NI0Hx1rrE
InChI InChI=1S/C17H30O4/c1-6-12(4)16(18)21-15-13(5)20-17(19)14(15)10-8-7-9-11(2)3/h11-15H,6-10H2,1-5H3/t12?,13-,14+,15-/m0/s1
InChIKey REOWDNXLFMNIHY-DKUMPPAJSA-N
Mol Weight 298.42 g/mol
Molecular Formula C17H30O4
Exact Mass 298.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Jw9jK9HH6
Name (RS)-(2S,3R,4R)-2-Methyl-4-(5-methylhexyl)-5-oxotetrahydrofuran-3-yl 2-methylbutanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H30O4
InChI InChI=1S/C17H30O4/c1-6-12(4)16(18)21-15-13(5)20-17(19)14(15)10-8-7-9-11(2)3/h11-15H,6-10H2,1-5H3/t12?,13-,14+,15-/m0/s1
InChIKey REOWDNXLFMNIHY-DKUMPPAJSA-N
Literature Reference DOI 10.1002/cbic.201200260
Molecular Weight 298.423 g/mol
SMILES C1(O[C@]([C@@]([C@]1(CCCCC(C)C)[H])(OC(C(CC)C)=O)[H])(C)[H])=O
SPLASH splash10-052k-9100000000-c052c7ba89dd69137e35
Source of Spectrum CBC-13-1635/SM38-81
Synonyms (2S,3R,4R)-2-methyl-4-(5-methylhexyl)-5-oxotetrahydrofuran-3-yl 2-methylbutanoate
Wiley ID 1786777