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Propanedioic acid, [(3-methylenecyclobutyl)methyl]-, diethyl ester
SpectraBase Compound ID DhynYX4bzUa
InChI InChI=1S/C13H20O4/c1-4-16-12(14)11(13(15)17-5-2)8-10-6-9(3)7-10/h10-11H,3-8H2,1-2H3
InChIKey UMNAFNBUCODUGO-UHFFFAOYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C13H20O4
Exact Mass 240.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6F83I8WfHsB
Name Propanedioic acid, [(3-methylenecyclobutyl)methyl]-, diethyl ester
Alternate Name(s) Diethyl 2-[(3-methylenecyclobutyl)methyl]malonate Ethyl 2-(ethoxycarbonyl)-3-(3'-methylenecyclobutyl)-propanoate
CAS Registry Number 122699-55-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O4
InChI InChI=1S/C13H20O4/c1-4-16-12(14)11(13(15)17-5-2)8-10-6-9(3)7-10/h10-11H,3-8H2,1-2H3
InChIKey UMNAFNBUCODUGO-UHFFFAOYSA-N
Molecular Weight 240.299 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)CC1CC(C1)=C
SPLASH splash10-006x-4900000000-649a591e470f5a7e88a2
Source of Spectrum J-54-4948-20
Wiley ID 1242867