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CAS Number: 208665-95-6
3-bromo-4-isobutoxybenzonitrile

Structure

 3-bromo-4-isobutoxybenzonitrile
Name: 3-bromo-4-isobutoxybenzonitrile
Synonyms:
General Information
Product Number: 208665956

CAS Registry Number 208665-95-6
Name:
Benzonitrile, 3-?bromo-?4-?(2-?methylpropoxy)?-
3-Bromo-4-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)7-14-11-4-3-9(6-13)5-10(11)12/h3-5,8H,7H2,1-2H3

InChI Key:KMXCJFAXAMLPTC-UHFFFAOYSA-N

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

Specification

98%
References

PCT Int. Appl. (2011), WO 2011141933 A2 20111117.                                  

PCT Int. Appl. (2010), WO 2010142653 A1 20101216.
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