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4-(Dibromoacetyl)benzonitrile
SpectraBase Compound ID 35scEr0NXBm
InChI InChI=1S/C9H5Br2NO/c10-9(11)8(13)7-3-1-6(5-12)2-4-7/h1-4,9H
InChIKey FAAUFCFIFBFMRL-UHFFFAOYSA-N
Mol Weight 302.95 g/mol
Molecular Formula C9H5Br2NO
Exact Mass 300.87379 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2RyAGp5JkiB
Name 4-(Dibromoacetyl)benzonitrile
Alternate Name(s) 4-(2,2-dibromo-1-oxoethyl)benzonitrile 4-(2,2-Dibromoacetyl)benzonitrile 4-[2,2-Bis(bromanyl)ethanoyl]benzenecarbonitrile Benzonitrile, p-(dibromoacetyl)-
CAS Registry Number 21661-87-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H5Br2NO
InChI InChI=1S/C9H5Br2NO/c10-9(11)8(13)7-3-1-6(5-12)2-4-7/h1-4,9H
InChIKey FAAUFCFIFBFMRL-UHFFFAOYSA-N
Molecular Weight 302.953 g/mol
SMILES C(=O)(c1ccc(cc1)C#N)C(Br)Br
SPLASH splash10-001i-2900000000-ae9923544c8979e3e175
Wiley ID 1502471