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Methyl (2RS, 3SR)-2-butanoyloxy-3-methylpentanoate
SpectraBase Compound ID 9ovJGuSOhqh
InChI InChI=1S/C11H20O4/c1-5-7-9(12)15-10(8(3)6-2)11(13)14-4/h8,10H,5-7H2,1-4H3/t8-,10+/m0/s1
InChIKey WKHSDQKALLZGBL-WCBMZHEXSA-N
Mol Weight 216.28 g/mol
Molecular Formula C11H20O4
Exact Mass 216.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 98QFq7pGcxt
Name Methyl (2RS, 3SR)-2-butanoyloxy-3-methylpentanoate
Classification Fatty acid esters
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 216.136159120 u
Formula C11H20O4
InChI InChI=1S/C11H20O4/c1-5-7-9(12)15-10(8(3)6-2)11(13)14-4/h8,10H,5-7H2,1-4H3/t8-,10+/m0/s1
InChIKey WKHSDQKALLZGBL-WCBMZHEXSA-N
Molecular Weight 216.277 g/mol
Number of Peaks 6
SMILES CC[C@](C)([C@@](OC(=O)CCC)(C(=O)OC)[H])[H]
SPLASH splash10-00di-9100000000-cd5626dcb9386d9a9596
Source of Spectrum FF-20-378-22 (DOI: 10.1002/ffj.1510)
Synonyms (2R,3S)-methyl 2-(butyryloxy)-3-methylpentanoate
Wiley ID 1775403