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(2-Cyano,1-methyl)ethyl propanedioic acid, dimethyl ester
SpectraBase Compound ID 3GvOYYcarL3
InChI InChI=1S/C9H13NO4/c1-6(4-5-10)7(8(11)13-2)9(12)14-3/h6-7H,4H2,1-3H3
InChIKey BKUFHZUVRBCWEM-UHFFFAOYSA-N
Mol Weight 199.21 g/mol
Molecular Formula C9H13NO4
Exact Mass 199.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HC94wMP9JUj
Name Dimethyl 2-(2-cyano-1-methylethyl)malonate
CAS Registry Number 168430-02-2
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13NO4
InChI InChI=1S/C9H13NO4/c1-6(4-5-10)7(8(11)13-2)9(12)14-3/h6-7H,4H2,1-3H3
InChIKey BKUFHZUVRBCWEM-UHFFFAOYSA-N
Molecular Weight 199.206 g/mol
SMILES COC(=O)C(C(CC#N)C)C(=O)OC
SPLASH splash10-0api-9400000000-46eefc5bcf3445baf2af
Synonyms (2-Cyano,1-methyl)ethyl propanedioic acid, dimethyl ester 2-(1-cyanopropan-2-yl)propanedioic acid dimethyl ester 2-(2-cyano-1-methyl-ethyl)malonic acid dimethyl ester Dimethyl 2-(1-cyanopropan-2-yl)propanedioate Dimethyl 2-(2-cyano-1-methyl-ethyl)propanedioate
Wiley ID 1469889