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isopentylmalonic acid, diethyl ester
SpectraBase Compound ID J6PkX7YEKIN
InChI InChI=1S/C12H22O4/c1-5-15-11(13)10(8-7-9(3)4)12(14)16-6-2/h9-10H,5-8H2,1-4H3
InChIKey MPJCIHOJXMCSIM-UHFFFAOYSA-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 DHUJvRkOSMG
Name Diethyl 2-isopentylmalonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O4
InChI InChI=1S/C12H22O4/c1-5-15-11(13)10(8-7-9(3)4)12(14)16-6-2/h9-10H,5-8H2,1-4H3
InChIKey MPJCIHOJXMCSIM-UHFFFAOYSA-N
Molecular Weight 230.304 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)CCC(C)C
SPLASH splash10-03di-0900000000-9a5df2c607d9bed7180b
Source of Spectrum K-128-67-2
Synonyms 2-(3-Methylbutyl)propanedioic acid diethyl ester 2-isoamylmalonic acid diethyl ester Diethyl 2-(3-methylbutyl)propanedioate Diethyl 2-isopentylpropanedioate
Wiley ID 1231676