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Isopropyl-malonic acid, dimethyl ester
SpectraBase Compound ID CelYhmxzfou
InChI InChI=1S/C8H14O4/c1-5(2)6(7(9)11-3)8(10)12-4/h5-6H,1-4H3
InChIKey HVNFMZHHKRLLNH-UHFFFAOYSA-N
Mol Weight 174.2 g/mol
Molecular Formula C8H14O4
Exact Mass 174.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JNT0IwJPrI
Name Propanedioic acid, (1-methylethyl)-, dimethyl ester
Alternate Name(s) Dimethyl 2-isopropylmalonate 2-isopropylmalonic acid dimethyl ester 2-Propan-2-ylpropanedioic acid dimethyl ester Dimethyl .alpha.-isopropyl malonate Dimethyl 2-isopropylpropanedioate Dimethyl 2-propan-2-ylpropanedioate Dimethyl isopropylmalonate Propanedioic acid, methylethyl- dimethyl ester
CAS Registry Number 51122-91-9
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O4
InChI InChI=1S/C8H14O4/c1-5(2)6(7(9)11-3)8(10)12-4/h5-6H,1-4H3
InChIKey HVNFMZHHKRLLNH-UHFFFAOYSA-N
Molecular Weight 174.196 g/mol
SMILES C(C(C(OC)=O)C(C)C)(OC)=O
SPLASH splash10-100u-9500000000-96d45eee20d811b9fa89
Source of Spectrum W5-1989-63213-2323
Wiley ID 1170336