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2-(3-Methylbut-2-enyl)malonic acid diethyl ester
SpectraBase Compound ID FYNF9dCwZ8c
InChI InChI=1S/C12H20O4/c1-5-15-11(13)10(8-7-9(3)4)12(14)16-6-2/h7,10H,5-6,8H2,1-4H3
InChIKey UXBLYMUHQJDAFO-UHFFFAOYSA-N
Mol Weight 228.29 g/mol
Molecular Formula C12H20O4
Exact Mass 228.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KzxHj7GGUFg
Name 2-(3-Methylbut-2-enyl)malonic acid diethyl ester
CAS Registry Number 22539-80-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O4
InChI InChI=1S/C12H20O4/c1-5-15-11(13)10(8-7-9(3)4)12(14)16-6-2/h7,10H,5-6,8H2,1-4H3
InChIKey UXBLYMUHQJDAFO-UHFFFAOYSA-N
Molecular Weight 228.288 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)CC=C(C)C
SPLASH splash10-0159-9400000000-f187d4e4dfac8d74d97b
Source of Spectrum F-47-8422-1
Synonyms Propanedioic acid, (3-methyl-2-butenyl)-, diethyl ester 2-(3-Methylbut-2-enyl)propanedioic acid diethyl ester Diethyl 2-(3-methyl-2-butenyl)malonate Diethyl 2-(3-methylbut-2-enyl)propanedioate
Wiley ID 1229550