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(1-Methylbutyl)-malonic acid, diethyl ester
SpectraBase Compound ID GlFAJ0W0JFw
InChI InChI=1S/C12H22O4/c1-5-8-9(4)10(11(13)15-6-2)12(14)16-7-3/h9-10H,5-8H2,1-4H3
InChIKey RQFSNEWORATSCC-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 FPH5ytk0o2j
Name Diethyl 2-(1-methylbutyl)malonate
Alternate Name(s) 1-(Methylbutyl)malonic acid diethyl ester 1-Methylbutyl malonic ester Diethyl (1-methylbutyl)malonate Malonic acid, (1-methylbutyl)-, diethyl ester Propanedioic acid, (1-methylbutyl)-, diethyl ester 2-Pentan-2-ylpropanedioic acid diethyl ester Diethyl 2-(1-methylbutyl)propanedioate Diethyl 2-pentan-2-ylpropanedioate
CAS Registry Number 117-47-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O4
InChI InChI=1S/C12H22O4/c1-5-8-9(4)10(11(13)15-6-2)12(14)16-7-3/h9-10H,5-8H2,1-4H3
InChIKey RQFSNEWORATSCC-UHFFFAOYSA-N
Molecular Weight 230.304 g/mol
SMILES CCOC(=O)C(C(OCC)=O)C(C)CCC
SPLASH splash10-03di-6900000000-5922f239f7178b924f81
Source of Spectrum NP-5-9165-0
Wiley ID 1105285