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(RS)-(2S,3R,4R)-2-Methyl-4-((RS)-4-methylhexyl)-5-oxotetrahydrofuran-3-yl 2-methylbutanoate
SpectraBase Compound ID L8V7POiRPRY
InChI InChI=1S/C17H30O4/c1-6-11(3)9-8-10-14-15(13(5)20-17(14)19)21-16(18)12(4)7-2/h11-15H,6-10H2,1-5H3/t11?,12?,13-,14+,15-/m0/s1
InChIKey WTGIOIUGIOQLSR-PCGVCOGMSA-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 3YFAi2Rl5al
Name (RS)-(2S,3R,4R)-2-Methyl-4-((RS)-4-methylhexyl)-5-oxotetrahydrofuran-3-yl 2-methylbutanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H30O4
InChI InChI=1S/C17H30O4/c1-6-11(3)9-8-10-14-15(13(5)20-17(14)19)21-16(18)12(4)7-2/h11-15H,6-10H2,1-5H3/t11?,12?,13-,14+,15-/m0/s1
InChIKey WTGIOIUGIOQLSR-PCGVCOGMSA-N
Literature Reference DOI 10.1002/cbic.201200260
Molecular Weight 298.423 g/mol
SMILES C1(O[C@]([C@@]([C@]1(CCCC(CC)C)[H])(OC(C(CC)C)=O)[H])(C)[H])=O
SPLASH splash10-052k-9100000000-6ab52fedd57a117228d1
Source of Spectrum CBC-13-1635/SM38-80
Synonyms (2S,3R,4R)-2-methyl-4-(4-methylhexyl)-5-oxotetrahydrofuran-3-yl 2-methylbutanoate
Wiley ID 1786776