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2-Bromo-2-cyano-acetic acid isobutyl ester
SpectraBase Compound ID ElRiKJLBBXA
InChI InChI=1S/C7H10BrNO2/c1-5(2)4-11-7(10)6(8)3-9/h5-6H,4H2,1-2H3
InChIKey BLKQTRDCVAMXMR-UHFFFAOYSA-N
Mol Weight 220.07 g/mol
Molecular Formula C7H10BrNO2
Exact Mass 218.989492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C5bNOih9uAP
Name 2-Bromo-2-cyano-acetic acid isobutyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10BrNO2
InChI InChI=1S/C7H10BrNO2/c1-5(2)4-11-7(10)6(8)3-9/h5-6H,4H2,1-2H3
InChIKey BLKQTRDCVAMXMR-UHFFFAOYSA-N
Molecular Weight 220.066 g/mol
SMILES C(C(C#N)Br)(=O)OCC(C)C
SPLASH splash10-0kmj-3590000000-4376706d1bf26b7c0980
Source of Spectrum SO-0-769-2
Synonyms 2-Bromo-2-cyanoacetic acid 2-methylpropyl ester 2-Methylpropyl 2-bromanyl-2-cyano-ethanoate 2-Methylpropyl 2-bromo-2-cyanoacetate isobutyl 2-bromo-2-cyano-acetate
Wiley ID 1541575