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3,4-Dimethyl-2-oxo-5-(1H)pyrrolylideneacetic acid, .alpha.-cyano-, t-butyl ester
SpectraBase Compound ID F2O7MWocBjE
InChI InChI=1S/C13H16N2O3/c1-7-8(2)11(16)15-10(7)9(6-14)12(17)18-13(3,4)5/h9H,1-5H3
InChIKey XJXOUZRMVSLQLV-UHFFFAOYSA-N
Mol Weight 248.28 g/mol
Molecular Formula C13H16N2O3
Exact Mass 248.116092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Z59OcWUVpV
Name 3,4-Dimethyl-2-oxo-5-(1H)pyrrolylideneacetic acid, .alpha.-cyano-, t-butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O3
InChI InChI=1S/C13H16N2O3/c1-7-8(2)11(16)15-10(7)9(6-14)12(17)18-13(3,4)5/h9H,1-5H3
InChIKey XJXOUZRMVSLQLV-UHFFFAOYSA-N
Molecular Weight 248.282 g/mol
SMILES CC(C)(C)OC(=O)C(C#N)C=1C(=C(C(N1)=O)C)C
SPLASH splash10-0a4m-9700000000-673e36446ff1ead0db8a
Synonyms tert-Butyl (2E)-cyano(3,4-dimethyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)ethanoate tert-Butyl cyano(3,4-dimethyl-2-oxo-2H-pyrrol-5-yl)acetate
Wiley ID 1478880