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(2S,3R,4R)-2-Methyl-4-(5-methylhexyl)-5-oxotetrahydrofuran-3-yl 3-methylbutanoate
SpectraBase Compound ID JcYCXmhVJJ6
InChI InChI=1S/C17H30O4/c1-11(2)8-6-7-9-14-16(13(5)20-17(14)19)21-15(18)10-12(3)4/h11-14,16H,6-10H2,1-5H3/t13-,14+,16-/m0/s1
InChIKey WAKBRVKZLAMPKI-LZWOXQAQSA-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 IOid3wwEPfe
Name (2S,3R,4R)-2-Methyl-4-(5-methylhexyl)-5-oxotetrahydrofuran-3-yl 3-methylbutanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H30O4
InChI InChI=1S/C17H30O4/c1-11(2)8-6-7-9-14-16(13(5)20-17(14)19)21-15(18)10-12(3)4/h11-14,16H,6-10H2,1-5H3/t13-,14+,16-/m0/s1
InChIKey WAKBRVKZLAMPKI-LZWOXQAQSA-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(CC(C)C)=O)[H])(C)[H])=O
SPLASH splash10-052s-9010000000-db82ae68d67c3a96edb1
Source of Spectrum CBC-13-1635/SM38-82
Wiley ID 1786778