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Ethyl (2RS, 3SR)-2-isobutyryloxy-3-methylpentanoate
SpectraBase Compound ID Dywx3I2nEng
InChI InChI=1S/C12H22O4/c1-6-9(5)10(12(14)15-7-2)16-11(13)8(3)4/h8-10H,6-7H2,1-5H3/t9-,10+/m0/s1
InChIKey HOYVSUQZNYMSPS-VHSXEESVSA-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 B46A0hAKl8P
Name Ethyl (2RS, 3SR)-2-isobutyryloxy-3-methylpentanoate
Alternate Name(s) (2R,3S)-ethyl 2-(isobutyryloxy)-3-methylpentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O4
InChI InChI=1S/C12H22O4/c1-6-9(5)10(12(14)15-7-2)16-11(13)8(3)4/h8-10H,6-7H2,1-5H3/t9-,10+/m0/s1
InChIKey HOYVSUQZNYMSPS-VHSXEESVSA-N
Literature Reference DOI 10.1002/ffj.1510
Molecular Weight 230.304 g/mol
SMILES CC[C@](C)([C@@](OC(C(C)C)=O)(C(OCC)=O)[H])[H]
SPLASH splash10-00dl-9100000000-cacc11896dfbeff438d4
Source of Spectrum FF-20-379-32
Wiley ID 1775413