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2-[(E)-hex-2-enyl]malonic acid dimethyl ester
SpectraBase Compound ID ElDXW84V1Gi
InChI InChI=1S/C11H18O4/c1-4-5-6-7-8-9(10(12)14-2)11(13)15-3/h6-7,9H,4-5,8H2,1-3H3/b7-6+
InChIKey OFOCVWIEUIHRMG-VOTSOKGWSA-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 AsabskBcCQg
Name 2-[(E)-hex-2-enyl]malonic acid dimethyl ester
Alternate Name(s) Propanedioic acid, 2-hexenyl-, dimethyl ester Dimethyl 2-[(2E)-2-hexenyl]malonate 2-[(E)-hex-2-enyl]propanedioic acid dimethyl ester Dimethyl 2-[(E)-hex-2-enyl]propanedioate
CAS Registry Number 74810-84-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O4
InChI InChI=1S/C11H18O4/c1-4-5-6-7-8-9(10(12)14-2)11(13)15-3/h6-7,9H,4-5,8H2,1-3H3/b7-6+
InChIKey OFOCVWIEUIHRMG-VOTSOKGWSA-N
Molecular Weight 214.261 g/mol
SMILES CCC\C=C\CC(C(=O)OC)C(=O)OC
SPLASH splash10-06si-9600000000-5de2b0fafe49a6f83540
Source of Spectrum W5-17423-0-0
Wiley ID 1213334