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Diethyl 2-octylmalonate
SpectraBase Compound ID 8yrY8pgTJxr
InChI InChI=1S/C15H28O4/c1-4-7-8-9-10-11-12-13(14(16)18-5-2)15(17)19-6-3/h13H,4-12H2,1-3H3
InChIKey YZYBVYGISZANLI-UHFFFAOYSA-N
Mol Weight 272.38 g/mol
Molecular Formula C15H28O4
Exact Mass 272.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5tBLvXA6p4F
Name Diethyl 2-octylmalonate
Alternate Name(s) 2-Octylmalonic acid diethyl ester 2-Octylpropanedioic acid diethyl ester Diethyl 2-octylpropanedioate Diethyl octylmalonate Malonic acid, octyl-, diethyl ester Propanedioic acid, octyl-, diethyl ester
CAS Registry Number 1472-85-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H28O4
InChI InChI=1S/C15H28O4/c1-4-7-8-9-10-11-12-13(14(16)18-5-2)15(17)19-6-3/h13H,4-12H2,1-3H3
InChIKey YZYBVYGISZANLI-UHFFFAOYSA-N
Molecular Weight 272.385 g/mol
SMILES C(=O)(C(C(OCC)=O)CCCCCCCC)OCC
SPLASH splash10-08pl-9810000000-ce46ea601dd52b283b91
Source of Spectrum N-23-173-6
Wiley ID 1276170