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CAS Number: 876918-26-2
5-bromo-2-isobutoxybenzonitrile

Structure

 5-bromo-2-isobutoxybenzonitrile
Name: 5-bromo-2-isobutoxybenzonitrile
Synonyms:
General Information
Product Number: 876918262

CAS Registry Number 876918-26-2
Name:
Benzonitrile, 5-?bromo-?2-?(2-?methylpropoxy)?-
5-Bromo-2-isobutoxybenzonitrile

 

Chemical Formula: C11H12BrNO
Exact Mass: 253.01
Molecular Weight: 254.12
m/z: 253.01 (100.0%), 255.01 (97.5%), 254.01 (12.3%), 256.01 (12.1%)

 

InChI:InChI=1S/C11H12BrNO/c1-8(2)7-14-11-4-3-10(12)5-9(11)6-13/h3-5,8H,7H2,1-2H3

InChI Key:RAKIUYAOJQVFIN-UHFFFAOYSA-N

Canonical SMILES:CC(C)COC1=C(C=C(C=C1)Br)C#N

Specification

98%
References

PCT Int. Appl. (2013), WO 2013050996 A2 20130411.

PCT Int. Appl. (2011), WO 2011073617 A1 20110623. 
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