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2-Bromanyl-2-phenyl-ethanenitrile
SpectraBase Compound ID DeRWKYE9FlG
InChI InChI=1S/C8H6BrN/c9-8(6-10)7-4-2-1-3-5-7/h1-5,8H
InChIKey XUHFBOUSHUEAQZ-UHFFFAOYSA-N
Mol Weight 196.05 g/mol
Molecular Formula C8H6BrN
Exact Mass 194.968362 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4rBF3jNSZbw
Name 2-Bromanyl-2-phenyl-ethanenitrile
Alternate Name(s) 2-Bromo-2-phenyl-acetonitrile Acetic acid, bromophenyl-, nitrile Acetonitrile, bromophenyl- Brombenzyl cyanide Bromo(phenyl)acetonitrile Bromobenzyl cyanide Bromobenzylnitrile CA (TEAR GAS) Camite BRN 1862309 EINECS 227-348-8 HSDB 1982
CAS Registry Number 5798-79-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6BrN
InChI InChI=1S/C8H6BrN/c9-8(6-10)7-4-2-1-3-5-7/h1-5,8H
InChIKey XUHFBOUSHUEAQZ-UHFFFAOYSA-N
Molecular Weight 196.047 g/mol
SMILES c1cccc(c1)C(C#N)Br
SPLASH splash10-014i-9700000000-cea52bddfe7950051617
Source of Spectrum AD-0-2532-0
Wiley ID 1434468