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CAS Number: 628311-33-1
2-(3-bromo-4-methoxyphenyl)-2-methylpropanenitrile

Structure

2-(3-bromo-4-methoxyphenyl)-2-methylpropanenitrile
Name: 2-(3-bromo-4-methoxyphenyl)-2-methylpropanenitrile
Synonyms:
General Information
Product Number: 628311331

CAS Registry Number 628311-33-1
Name:
Benzeneacetonitrile, 3-​bromo-​4-​methoxy-​α,​α-​dimethyl-
2-(3-Bromo-4-methoxyphenyl)-2-methylpropionitrile

 

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/c1-11(2,7-13)8-4-5-10(14-3)9(12)6-8/h4-6H,1-3H3

InChI Key:JGGZPGKGGBQLJA-UHFFFAOYSA-N

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

Specification

98%

References

(1) Kromann, Hasse; European Journal of Medicinal Chemistry 2004, V39(11), P993-1000 CAPLUS

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