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N-Acetyl-4-(bromomethyl)-3-(2,2-dicyanoethyl)-2-pyrrolidone
SpectraBase Compound ID LS1AN7BXXZb
InChI InChI=1S/C11H12BrN3O2/c1-7(16)15-6-9(3-12)10(11(15)17)2-8(4-13)5-14/h8-10H,2-3,6H2,1H3
InChIKey WXYYGKIOZQQRSP-UHFFFAOYSA-N
Mol Weight 298.14 g/mol
Molecular Formula C11H12BrN3O2
Exact Mass 297.01129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F3ddyethfS0
Name N-Acetyl-4-(bromomethyl)-3-(2,2-dicyanoethyl)-2-pyrrolidone
Alternate Name(s) 2-{[1-acetyl-4-(bromomethyl)-2-oxo-3-pyrrolidinyl]methyl}malononitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12BrN3O2
InChI InChI=1S/C11H12BrN3O2/c1-7(16)15-6-9(3-12)10(11(15)17)2-8(4-13)5-14/h8-10H,2-3,6H2,1H3
InChIKey WXYYGKIOZQQRSP-UHFFFAOYSA-N
Molecular Weight 298.140 g/mol
SMILES C1(N(CC(C1CC(C#N)C#N)CBr)C(=O)C)=O
SPLASH splash10-0006-9010000000-7642009dc6777868d995
Source of Spectrum J-64-2352-27
Wiley ID 1529778