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Ethyl (2RS, 3RS)-2-butanoyloxy-3-methylpentanoate
SpectraBase Compound ID 4Hh7hPw7udm
InChI InChI=1S/C12H22O4/c1-5-8-10(13)16-11(9(4)6-2)12(14)15-7-3/h9,11H,5-8H2,1-4H3/t9-,11-/m1/s1
InChIKey VNJHYNFUVWZAFR-MWLCHTKSSA-N
Mol Weight 230.3 g/mol
Molecular Formula C12H22O4
Exact Mass 230.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LMUWXyr7RuR
Name Ethyl (2RS, 3RS)-2-butanoyloxy-3-methylpentanoate
Alternate Name(s) (2R,3R)-ethyl 2-(butyryloxy)-3-methylpentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O4
InChI InChI=1S/C12H22O4/c1-5-8-10(13)16-11(9(4)6-2)12(14)15-7-3/h9,11H,5-8H2,1-4H3/t9-,11-/m1/s1
InChIKey VNJHYNFUVWZAFR-MWLCHTKSSA-N
Literature Reference DOI 10.1002/ffj.1510
Molecular Weight 230.304 g/mol
SMILES CC[C@@](C)([C@@](OC(=O)CCC)(C(OCC)=O)[H])[H]
SPLASH splash10-00di-9100000000-a65443b9a715021fccbf
Source of Spectrum FF-20-379-29
Wiley ID 1775410