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CAS Number: 1260761-83-8
4-acetyl-3-bromobenzonitrile

Structure

4-acetyl-3-bromobenzonitrile
Name: 4-acetyl-3-bromobenzonitrile
Synonyms:
General Information
Product Number: 1260761838

CAS Registry Number 1260761-83-8
Name:
Benzonitrile, 4-​acetyl-​3-​bromo-
4-Acetyl-3-bromobenzonitrile

 

Chemical Formula: C9H6BrNO
Exact Mass: 222.96
Molecular Weight: 224.05
m/z: 222.96 (100.0%), 224.96 (97.3%), 223.97 (9.8%), 225.96 (9.8%)

 

InChI:InChI=1S/C9H6BrNO/c1-6(12)8-3-2-7(5-11)4-9(8)10/h2-4H,1H3

InChI Key:KYIGKPZOSZSXGB-UHFFFAOYSA-N

Canonical SMILES:CC(=O)C1=C(C=C(C=C1)C#N)Br

Specification

98%

References

PCT Int. Appl. (2010), WO 2010074089 A1 20100701. 

PCT Int. Appl. (2010), WO 2010074088 A1 20100701.                                 

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