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Racemic 2-methyl-3-oxovaleric acid 4-oxopentyl ester
SpectraBase Compound ID 9N0qfF162Uq
InChI InChI=1S/C11H18O4/c1-4-10(13)9(3)11(14)15-7-5-6-8(2)12/h9H,4-7H2,1-3H3
InChIKey ZTICCHCMZZBHKY-UHFFFAOYSA-N
Mol Weight 214.26 g/mol
Molecular Formula C11H18O4
Exact Mass 214.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2dXTFUfFdQu
Name Racemic 2-methyl-3-oxovaleric acid 4-oxopentyl ester
Alternate Name(s) 4-Oxopentyl 2-methyl-3-oxopentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O4
InChI InChI=1S/C11H18O4/c1-4-10(13)9(3)11(14)15-7-5-6-8(2)12/h9H,4-7H2,1-3H3
InChIKey ZTICCHCMZZBHKY-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cbic.201800799
Molecular Weight 214.261 g/mol
SMILES C(C(C(C(=O)OCCCC(C)=O)C)=O)C
SPLASH splash10-052r-9000000000-ccfac5d7406515b37155
Source of Spectrum CBC-20-SM6-5
Wiley ID 1819382