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.alpha.,.alpha.-dibromo-3-cyano-5-nitrotoluene
SpectraBase Compound ID JBv7pKkpWiq
InChI InChI=1S/C8H4Br2N2O2/c9-8(10)6-1-5(4-11)2-7(3-6)12(13)14/h1-3,8H
InChIKey IIECOBNEBMQBBJ-UHFFFAOYSA-N
Mol Weight 319.94 g/mol
Molecular Formula C8H4Br2N2O2
Exact Mass 317.863953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cp88tu1semS
Name .alpha.,.alpha.-dibromo-3-cyano-5-nitrotoluene
CAS Registry Number 124289-28-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H4Br2N2O2
InChI InChI=1S/C8H4Br2N2O2/c9-8(10)6-1-5(4-11)2-7(3-6)12(13)14/h1-3,8H
InChIKey IIECOBNEBMQBBJ-UHFFFAOYSA-N
Molecular Weight 319.940 g/mol
SMILES c1(N(=O)=O)cc(C(Br)Br)cc(C#N)c1
SPLASH splash10-00ku-0390000000-43f2725f83c54331c42e
Source of Spectrum J-55-1043-9
Synonyms 3-(dibromomethyl)-5-nitrobenzonitrile
Wiley ID 1317934